[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(4-ethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(4-ethoxyphenyl)carbonylamino]ethanoate Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-[(4-ethoxybenzoyl)amino]acetate CAS Name: 2-[[(4-ethoxyphenyl)-oxomethyl]amino]acetic acid [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl] 2-[(4-ethoxybenzoyl)amino]acetate Traditional Name: 2-[(4-ethoxybenzoyl)amino]acetic acid [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)OC(C)C(=O)N2CCCCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)O[C@H](C)C(=O)N2CCCCCC2

InChI

InChI=1S/C20H28N2O5/c1-3-26-17-10-8-16(9-11-17)19(24)21-14-18(23)27-15(2)20(25)22-12-6-4-5-7-13-22/h8-11,15H,3-7,12-14H2,1-2H3,(H,21,24)/t15-/m1/s1