3-[[(Z)-2-[(4-acetamidophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[(Z)-2-[(4-acetamidophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[(Z)-2-[(4-acetamidobenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[(Z)-2-[[(4-acetamidophenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[(Z)-2-[(4-acetamidobenzoyl)amino]-3-phenylprop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[(Z)-2-[(4-acetamidobenzoyl)amino]-3-phenyl-acryloyl]amino]benzoic acid Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C25H21N3O5/c1-16(29)26-20-12-10-18(11-13-20)23(30)28-22(14-17-6-3-2-4-7-17)24(31)27-21-9-5-8-19(15-21)25(32)33/h2-15H,1H3,(H,26,29)(H,27,31)(H,28,30)(H,32,33)/b22-14-