(2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioic acid

Systemtic Name: (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioic acid Openeye Name: (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioic acid CAS Name: (2S)-2-[[(E)-1-oxo-3-(4-phenylphenyl)prop-2-enyl]amino]butanedioic acid IUPAC Name: (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioic acid Traditional Name: (2S)-2-[[(E)-3-(4-phenylphenyl)acryloyl]amino]succinic acid Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C=CC(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C(=O)N[C@@H](CC(=O)O)C(=O)O

InChI

InChI=1S/C19H17NO5/c21-17(20-16(19(24)25)12-18(22)23)11-8-13-6-9-15(10-7-13)14-4-2-1-3-5-14/h1-11,16H,12H2,(H,20,21)(H,22,23)(H,24,25)/b11-8+/t16-/m0/s1