[2-[cyclohexen-1-yl(propyl)amino]-2-oxidanylidene-ethyl] 4-(acetamidomethyl)benzoate

Systemtic Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxidanylidene-ethyl] 4-(acetamidomethyl)benzoate Openeye Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxo-ethyl] 4-(acetamidomethyl)benzoate CAS Name: 4-(acetamidomethyl)benzoic acid [2-[1-cyclohexenyl(propyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxoethyl] 4-(acetamidomethyl)benzoate Traditional Name: 4-(acetamidomethyl)benzoic acid [2-[cyclohexen-1-yl(propyl)amino]-2-keto-ethyl] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)CNC(=O)C

Isomeric SMILES

CCCN(C1=CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)CNC(=O)C

InChI

InChI=1S/C21H28N2O4/c1-3-13-23(19-7-5-4-6-8-19)20(25)15-27-21(26)18-11-9-17(10-12-18)14-22-16(2)24/h7,9-12H,3-6,8,13-15H2,1-2H3,(H,22,24)