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

Systemtic Name: 4-[[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]methyl]benzoate Openeye Name: 4-[[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]methyl]benzoate CAS Name: 4-[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]methyl]benzoate IUPAC Name: 4-[[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]methyl]benzoate Traditional Name: 4-[[[(E)-3-(4-chlorophenyl)acryloyl]amino]methyl]benzoate Formula: C17H13ClNO3- MolecularWeight: 314.74302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C=CC2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)/C=C/C2=CC=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C17H14ClNO3/c18-15-8-3-12(4-9-15)5-10-16(20)19-11-13-1-6-14(7-2-13)17(21)22/h1-10H,11H2,(H,19,20)(H,21,22)/p-1/b10-5+