[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)-methyl-amino] benzoate

Systemtic Name: [(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)-methyl-amino] benzoate Openeye Name: [(5,5-dimethyl-3-oxo-cyclohexen-1-yl)-methyl-amino] benzoate CAS Name: benzoic acid [(5,5-dimethyl-3-oxo-1-cyclohexenyl)-methylamino] ester IUPAC Name: [(5,5-dimethyl-3-oxocyclohexen-1-yl)-methylamino] benzoate Traditional Name: benzoic acid [(3-keto-5,5-dimethyl-cyclohexen-1-yl)-methyl-amino] ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)N(C)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)N(C)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H19NO3/c1-16(2)10-13(9-14(18)11-16)17(3)20-15(19)12-7-5-4-6-8-12/h4-9H,10-11H2,1-3H3