4-benzamidobutyl-[(2S)-2-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]carbamoyl]-4-phenyl-butyl]phosphinic acid

Systemtic Name: 4-benzamidobutyl-[(2S)-2-[[(2S)-4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl]carbamoyl]-4-phenyl-butyl]phosphinic acid Openeye Name: 4-benzamidobutyl-[(2S)-2-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]carbamoyl]-4-phenyl-butyl]phosphinic acid CAS Name: [(2S)-2-[[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-4-phenylbutyl]-(4-benzamidobutyl)phosphinic acid IUPAC Name: [(2S)-2-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]carbamoyl]-4-phenylbutyl]-(4-benzamidobutyl)phosphinic acid Traditional Name: 4-benzamidobutyl-[(2S)-2-[[(1S)-3-methyl-1-(phenylcarbamoyl)butyl]carbamoyl]-4-phenyl-butyl]phosphinic acid Formula: C34H44N3O5P MolecularWeight: 605.704021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(CCC2=CC=CC=C2)CP(=O)(CCCCNC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)[C@H](CCC2=CC=CC=C2)CP(=O)(CCCCNC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C34H44N3O5P/c1-26(2)24-31(34(40)36-30-18-10-5-11-19-30)37-33(39)29(21-20-27-14-6-3-7-15-27)25-43(41,42)23-13-12-22-35-32(38)28-16-8-4-9-17-28/h3-11,14-19,26,29,31H,12-13,20-25H2,1-2H3,(H,35,38)(H,36,40)(H,37,39)(H,41,42)/t29-,31+/m1/s1