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

Systemtic Name: (2S)-2-[(4-dimethylaminophenyl)methylamino]-5-oxidanylidene-5-[(4-phenylphenyl)carbonylamino]pentanoic acid Openeye Name: (2S)-2-[(4-dimethylaminophenyl)methylamino]-5-oxo-5-[(4-phenylbenzoyl)amino]pentanoic acid CAS Name: (2S)-2-[(4-dimethylaminophenyl)methylamino]-5-oxo-5-[[oxo-(4-phenylphenyl)methyl]amino]pentanoic acid IUPAC Name: (2S)-2-[(4-dimethylaminophenyl)methylamino]-5-oxo-5-[(4-phenylbenzoyl)amino]pentanoic acid Traditional Name: (2S)-2-[[4-(dimethylamino)benzyl]amino]-5-keto-5-[(4-phenylbenzoyl)amino]valeric acid Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)C1=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/C27H29N3O4/c1-30(2)23-14-8-19(9-15-23)18-28-24(27(33)34)16-17-25(31)29-26(32)22-12-10-21(11-13-22)20-6-4-3-5-7-20/h3-15,24,28H,16-18H2,1-2H3,(H,33,34)(H,29,31,32)/t24-/m0/s1