2-[[(E)-2-chloranyl-3-(4-methylphenyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-2-chloranyl-3-(4-methylphenyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(E)-2-chloro-3-(p-tolyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-2-chloro-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(E)-2-chloro-3-(4-methylphenyl)prop-2-enoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(E)-2-chloro-3-(p-tolyl)acryloyl]amino]-3-phenyl-propionic acid Formula: C19H18ClNO3 MolecularWeight: 343.80412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C(=O)NC(CC2=CC=CC=C2)C(=O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C(=O)NC(CC2=CC=CC=C2)C(=O)O)/Cl

InChI

InChI=1S/C19H18ClNO3/c1-13-7-9-15(10-8-13)11-16(20)18(22)21-17(19(23)24)12-14-5-3-2-4-6-14/h2-11,17H,12H2,1H3,(H,21,22)(H,23,24)/b16-11+