(2S)-2-[(4-ethenylphenyl)methylamino]-5-oxidanylidene-5-[(4-phenylphenyl)carbonylamino]pentanoic acid

Systemtic Name: (2S)-2-[(4-ethenylphenyl)methylamino]-5-oxidanylidene-5-[(4-phenylphenyl)carbonylamino]pentanoic acid Openeye Name: (2S)-5-oxo-5-[(4-phenylbenzoyl)amino]-2-[(4-vinylphenyl)methylamino]pentanoic acid CAS Name: (2S)-2-[(4-ethenylphenyl)methylamino]-5-oxo-5-[[oxo-(4-phenylphenyl)methyl]amino]pentanoic acid IUPAC Name: (2S)-2-[(4-ethenylphenyl)methylamino]-5-oxo-5-[(4-phenylbenzoyl)amino]pentanoic acid Traditional Name: (2S)-5-keto-5-[(4-phenylbenzoyl)amino]-2-[(4-vinylbenzyl)amino]valeric acid Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CNC(CCC(=O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C=CC1=CC=C(C=C1)CN[C@@H](CCC(=O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H26N2O4/c1-2-19-8-10-20(11-9-19)18-28-24(27(32)33)16-17-25(30)29-26(31)23-14-12-22(13-15-23)21-6-4-3-5-7-21/h2-15,24,28H,1,16-18H2,(H,32,33)(H,29,30,31)/t24-/m0/s1