[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate

Systemtic Name: [1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate Openeye Name: [2-[(4-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] (E)-3-(2-ethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2-ethoxyphenyl)-2-propenoic acid [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-o-phenetylacrylic acid [2-[(4-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC(=O)OC(C)C(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO4/c1-3-26-19-7-5-4-6-17(19)10-13-20(24)27-15(2)21(25)23-14-16-8-11-18(22)12-9-16/h4-13,15H,3,14H2,1-2H3,(H,23,25)/b13-10+