Methyl 3-[benzyl-(benzyl-(2-methoxycarbonylethenyl)amino)diazenyl-amino]prop-2-enoate

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Basic information

CAS: 58364-87-7
Standard SMILES: COC(=O)C=CN(Cc1ccccc1)N=NN(C=CC(=O)OC)Cc1ccccc1
InChIKey: WGWHBDYUEFOOAF-UHFFFAOYSA-N
Molecular formula: C22H24N4O4
Average molar mass: 408.4 g/mol
Monoisotopic mass: 408.17975526

Names & identifiers

Preferred name: Methyl 3-[benzyl-(benzyl-(2-methoxycarbonylethenyl)amino)diazenyl-amino]prop-2-enoate
IUPAC: methyl 3-[benzyl-[[benzyl-(3-methoxy-3-oxoprop-1-enyl)amino]diazenyl]amino]prop-2-enoate

Names & synonyms

58364-87-7METHYL 3-[BENZYL-(BENZYL-(2-METHOXYCARBONYLETHENYL)AMINO)DIAZENYL-AMINO]PROP-2-ENOATEDTXSID50319831Dimethyl 3,3'-(1,4-dibenzyltetraaz-2-ene-1,4-diyl)di(prop-2-enoate)

Database identifiers

CAS: 58364-87-7
PubChem CID: 336516
DTXSID: DTXSID50319831

Properties

Computed structural properties

XLogP: 4.5
Topological polar surface area: 83.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 8
Rotatable bonds: 12
Heavy atoms: 30
Formal charge: 0
Complexity: 556

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