4,4-dimethyl-3-[(2-oxidanyl-4-phenyl-butyl)-[[3-oxidanyl-2-(quinolin-2-ylcarbonylamino)butanoyl]amino]carbamoyl]pentanoate

Systemtic Name: 4,4-dimethyl-3-[(2-oxidanyl-4-phenyl-butyl)-[[3-oxidanyl-2-(quinolin-2-ylcarbonylamino)butanoyl]amino]carbamoyl]pentanoate Openeye Name: 3-[(2-hydroxy-4-phenyl-butyl)-[[3-hydroxy-2-(quinoline-2-carbonylamino)butanoyl]amino]carbamoyl]-4,4-dimethyl-pentanoate CAS Name: 3-[[[[3-hydroxy-1-oxo-2-[[oxo(2-quinolinyl)methyl]amino]butyl]amino]-(2-hydroxy-4-phenylbutyl)amino]-oxomethyl]-4,4-dimethylpentanoate IUPAC Name: 3-[(2-hydroxy-4-phenylbutyl)-[[3-hydroxy-2-(quinoline-2-carbonylamino)butanoyl]amino]carbamoyl]-4,4-dimethylpentanoate Traditional Name: 3-[(2-hydroxy-4-phenyl-butyl)-[[3-hydroxy-2-(quinaldoylamino)butanoyl]amino]carbamoyl]-4,4-dimethyl-valerate Formula: C32H39N4O7- MolecularWeight: 591.67466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NN(CC(CCC1=CC=CC=C1)O)C(=O)C(CC(=O)[O-])C(C)(C)C)NC(=O)C2=NC3=CC=CC=C3C=C2)O

Isomeric SMILES

CC(C(C(=O)NN(CC(CCC1=CC=CC=C1)O)C(=O)C(CC(=O)[O-])C(C)(C)C)NC(=O)C2=NC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C32H40N4O7/c1-20(37)28(34-29(41)26-17-15-22-12-8-9-13-25(22)33-26)30(42)35-36(31(43)24(18-27(39)40)32(2,3)4)19-23(38)16-14-21-10-6-5-7-11-21/h5-13,15,17,20,23-24,28,37-38H,14,16,18-19H2,1-4H3,(H,34,41)(H,35,42)(H,39,40)/p-1