[1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-propoxy-benzoate

Systemtic Name: [1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-propoxy-benzoate Openeye Name: [2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-ethoxy-4-propoxy-benzoate CAS Name: 3-ethoxy-4-propoxybenzoic acid [1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 3-ethoxy-4-propoxybenzoate Traditional Name: 3-ethoxy-4-propoxy-benzoic acid [2-[(2-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2Cl)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2Cl)OCC

InChI

InChI=1S/C22H26ClNO5/c1-4-12-28-19-11-10-16(13-20(19)27-5-2)22(26)29-15(3)21(25)24-14-17-8-6-7-9-18(17)23/h6-11,13,15H,4-5,12,14H2,1-3H3,(H,24,25)