methyl 4-[[[(E)-3-(4-acetamidophenyl)prop-2-enoyl]-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[(E)-3-(4-acetamidophenyl)prop-2-enoyl]-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[(E)-3-(4-acetamidophenyl)prop-2-enoyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[(E)-3-(4-acetamidophenyl)-1-oxoprop-2-enyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(E)-3-(4-acetamidophenyl)prop-2-enoyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[(E)-3-(4-acetamidophenyl)acryloyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=CC(=O)N(C)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)N(C)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H22N2O4/c1-15(24)22-19-11-6-16(7-12-19)8-13-20(25)23(2)14-17-4-9-18(10-5-17)21(26)27-3/h4-13H,14H2,1-3H3,(H,22,24)/b13-8+