(3S)-3-[[(E)-2-benzamido-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: (3S)-3-[[(E)-2-benzamido-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: (3S)-3-[[(E)-2-benzamido-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(E)-2-benzamido-1-oxo-3-phenylprop-2-enyl]amino]-3-phenylpropanoate IUPAC Name: (3S)-3-[[(E)-2-benzamido-3-phenylprop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: (3S)-3-[[(E)-2-benzamido-3-phenyl-acryloyl]amino]-3-phenyl-propionate Formula: C25H21N2O4- MolecularWeight: 413.44524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C(=O)NC(CC(=O)[O-])C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C=C(\C(=O)N[C@@H](CC(=O)[O-])C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H22N2O4/c28-23(29)17-21(19-12-6-2-7-13-19)26-25(31)22(16-18-10-4-1-5-11-18)27-24(30)20-14-8-3-9-15-20/h1-16,21H,17H2,(H,26,31)(H,27,30)(H,28,29)/p-1/b22-16+/t21-/m0/s1