2-[[butyl-(propan-2-ylcarbamoylamino)phosphoryl]methyl-(4-phenylbutanoyl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[butyl-(propan-2-ylcarbamoylamino)phosphoryl]methyl-(4-phenylbutanoyl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[[butyl-(isopropylcarbamoylamino)phosphoryl]methyl-(4-phenylbutanoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[butyl-[[oxo-(propan-2-ylamino)methyl]amino]phosphoryl]methyl-(1-oxo-4-phenylbutyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[[butyl-(propan-2-ylcarbamoylamino)phosphoryl]methyl-(4-phenylbutanoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[[butyl-(isopropylcarbamoylamino)phosphoryl]methyl-(4-phenylbutanoyl)amino]-4-methyl-valeric acid Formula: C25H42N3O5P MolecularWeight: 495.591841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCP(=O)(CN(C(CC(C)C)C(=O)O)C(=O)CCCC1=CC=CC=C1)NC(=O)NC(C)C

Isomeric SMILES

CCCCP(=O)(CN(C(CC(C)C)C(=O)O)C(=O)CCCC1=CC=CC=C1)NC(=O)NC(C)C

InChI

InChI=1S/C25H42N3O5P/c1-6-7-16-34(33,27-25(32)26-20(4)5)18-28(22(24(30)31)17-19(2)3)23(29)15-11-14-21-12-9-8-10-13-21/h8-10,12-13,19-20,22H,6-7,11,14-18H2,1-5H3,(H,30,31)(H2,26,27,32,33)