[2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 4-propoxybenzoate

Systemtic Name: [2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 4-propoxybenzoate Openeye Name: [2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-oxo-ethyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-oxoethyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C20H22ClNO4 MolecularWeight: 375.84598

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC(C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)N[C@H](C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H22ClNO4/c1-3-11-25-18-9-7-15(8-10-18)20(24)26-13-19(23)22-14(2)16-5-4-6-17(21)12-16/h4-10,12,14H,3,11,13H2,1-2H3,(H,22,23)/t14-/m1/s1