2-[[(E)-4-[(2-methyl-3-phenyl-propanoyl)amino]-6-phenyl-hex-2-enoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-4-[(2-methyl-3-phenyl-propanoyl)amino]-6-phenyl-hex-2-enoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(E)-4-[(2-methyl-3-phenyl-propanoyl)amino]-6-phenyl-hex-2-enoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-4-[(2-methyl-1-oxo-3-phenylpropyl)amino]-1-oxo-6-phenylhex-2-enyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(E)-4-[(2-methyl-3-phenylpropanoyl)amino]-6-phenylhex-2-enoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(E)-4-[(2-methyl-3-phenyl-propanoyl)amino]-6-phenyl-hex-2-enoyl]amino]-3-phenyl-propionic acid Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C(=O)NC(CCC2=CC=CC=C2)C=CC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)C(=O)NC(CCC2=CC=CC=C2)/C=C/C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C31H34N2O4/c1-23(21-25-13-7-3-8-14-25)30(35)32-27(18-17-24-11-5-2-6-12-24)19-20-29(34)33-28(31(36)37)22-26-15-9-4-10-16-26/h2-16,19-20,23,27-28H,17-18,21-22H2,1H3,(H,32,35)(H,33,34)(H,36,37)/b20-19+