[(1R)-1-[[3-(dipentylcarbamoyl)phenyl]carbonylamino]-2-phenyl-ethyl]-(2-methyl-3-oxidanylidene-3-phenylazanyl-propyl)phosphinic acid

Systemtic Name: [(1R)-1-[[3-(dipentylcarbamoyl)phenyl]carbonylamino]-2-phenyl-ethyl]-(2-methyl-3-oxidanylidene-3-phenylazanyl-propyl)phosphinic acid Openeye Name: (3-anilino-2-methyl-3-oxo-propyl)-[(1R)-1-[[3-(dipentylcarbamoyl)benzoyl]amino]-2-phenyl-ethyl]phosphinic acid CAS Name: (3-anilino-2-methyl-3-oxopropyl)-[(1R)-1-[[[3-[(dipentylamino)-oxomethyl]phenyl]-oxomethyl]amino]-2-phenylethyl]phosphinic acid IUPAC Name: (3-anilino-2-methyl-3-oxopropyl)-[(1R)-1-[[3-(dipentylcarbamoyl)benzoyl]amino]-2-phenylethyl]phosphinic acid Traditional Name: (3-anilino-3-keto-2-methyl-propyl)-[(1R)-1-[[3-(diamylcarbamoyl)benzoyl]amino]-2-phenyl-ethyl]phosphinic acid Formula: C36H48N3O5P MolecularWeight: 633.757181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C1=CC=CC(=C1)C(=O)NC(CC2=CC=CC=C2)P(=O)(CC(C)C(=O)NC3=CC=CC=C3)O

Isomeric SMILES

CCCCCN(CCCCC)C(=O)C1=CC=CC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)P(=O)(CC(C)C(=O)NC3=CC=CC=C3)O

InChI

InChI=1S/C36H48N3O5P/c1-4-6-14-23-39(24-15-7-5-2)36(42)31-20-16-19-30(26-31)35(41)38-33(25-29-17-10-8-11-18-29)45(43,44)27-28(3)34(40)37-32-21-12-9-13-22-32/h8-13,16-22,26,28,33H,4-7,14-15,23-25,27H2,1-3H3,(H,37,40)(H,38,41)(H,43,44)/t28?,33-/m1/s1