[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(3-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(3-methoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-[(3-methoxybenzoyl)amino]acetate CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]acetic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 2-[(3-methoxybenzoyl)amino]acetate Traditional Name: 2-(m-anisoylamino)acetic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)CNC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC(=O)CNC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C19H26N2O5/c1-14(19(24)21-10-5-3-4-6-11-21)26-17(22)13-20-18(23)15-8-7-9-16(12-15)25-2/h7-9,12,14H,3-6,10-11,13H2,1-2H3,(H,20,23)