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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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