[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 4-propoxybenzoate

Systemtic Name: [2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 4-propoxybenzoate Openeye Name: [2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-keto-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C19H27NO4 MolecularWeight: 333.42198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2CCCCC2C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC2CCCCC2C

InChI

InChI=1S/C19H27NO4/c1-3-12-23-16-10-8-15(9-11-16)19(22)24-13-18(21)20-17-7-5-4-6-14(17)2/h8-11,14,17H,3-7,12-13H2,1-2H3,(H,20,21)