Methyl 4,5-dimethoxy-2-[(2-phenylacetyl)amino]benzoate

HCID 892292

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Basic information

CAS: 496872-69-6
Standard SMILES: COC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc1ccccc1
InChIKey: PWNLNFQRNNJJIP-UHFFFAOYSA-N
Molecular formula: C18H19NO5
Average molar mass: 329.3 g/mol
Monoisotopic mass: 329.12632271

Names & identifiers

Preferred name: Methyl 4,5-dimethoxy-2-[(2-phenylacetyl)amino]benzoate
IUPAC: methyl 4,5-dimethoxy-2-[(2-phenylacetyl)amino]benzoate

Names & synonyms

Methyl 4,5-dimethoxy-2-[(2-phenylacetyl)amino]benzoate496872-69-6methyl 4,5-dimethoxy-2-[(phenylacetyl)amino]benzoateDTXSID601210492STK225704AKOS001312395SR-01000264617methyl 4,5-dimethoxy-2-(2-phenylacetamido)benzoateSR-01000264617-1Z28738002

Database identifiers

CAS: 496872-69-6
PubChem CID: 892292
DTXSID: DTXSID601210492

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 73.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 24
Formal charge: 0
Complexity: 422

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