Benzamide, N-(3-(diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitro-, hydrochloride

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Basic information

CAS: 7176-59-2
Standard SMILES: CCN(CC)CCCN(C(=O)c1ccc([N+](=O)[O-])cc1)C(C)c1ccccc1.Cl
InChIKey: FOOLCNYKBZPPDR-UHFFFAOYSA-N
Molecular formula: C22H30ClN3O3
Average molar mass: 419.9 g/mol
Monoisotopic mass: 419.1975695

Names & identifiers

Preferred name: Benzamide, N-(3-(diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitro-, hydrochloride
IUPAC: N-[3-(diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide;hydrochloride

Names & synonyms

N-(3-(Diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitrobenzamide hydrochloride7176-59-2Benzamide, N-(3-(diethylamino)propyl)-N-(alpha-methylbenzyl)-p-nitro-, hydrochlorideRefChem:322309DTXSID10992402N-[3-(Diethylamino)propyl]-4-nitro-N-(1-phenylethyl)benzamide--hydrogen chloride (1/1)

Database identifiers

CAS: 7176-59-2
PubChem CID: 201948
DTXSID: DTXSID10992402

Properties

Computed structural properties

Topological polar surface area: 69.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 9
Heavy atoms: 29
Formal charge: 0
Complexity: 476

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Compound notes

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