[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-[(4-methoxyphenyl)carbonylamino]benzoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-[(4-methoxyphenyl)carbonylamino]benzoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-[(4-methoxybenzoyl)amino]benzoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]benzoic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]benzoate Traditional Name: 2-(p-anisoylamino)benzoic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)N3CCCCCC3

InChI

InChI=1S/C23H26N2O5/c1-29-18-12-10-17(11-13-18)22(27)24-20-9-5-4-8-19(20)23(28)30-16-21(26)25-14-6-2-3-7-15-25/h4-5,8-13H,2-3,6-7,14-16H2,1H3,(H,24,27)