2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid

Systemtic Name: 2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid Openeye Name: 2-[[(2S)-2-(dibenzyloxyphosphorylmethylamino)-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid CAS Name: 2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-1-oxopentyl]amino]-4-(1H-indol-3-yl)butanoic acid IUPAC Name: 2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methylpentanoyl]amino]-4-(1H-indol-3-yl)butanoic acid Traditional Name: 2-[[(2S)-2-(dibenzoxyphosphorylmethylamino)-4-methyl-pentanoyl]amino]-4-(1H-indol-3-yl)butyric acid Formula: C33H40N3O6P MolecularWeight: 605.660961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCC1=CNC2=CC=CC=C21)C(=O)O)NCP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(CCC1=CNC2=CC=CC=C21)C(=O)O)NCP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C33H40N3O6P/c1-24(2)19-31(32(37)36-30(33(38)39)18-17-27-20-34-29-16-10-9-15-28(27)29)35-23-43(40,41-21-25-11-5-3-6-12-25)42-22-26-13-7-4-8-14-26/h3-16,20,24,30-31,34-35H,17-19,21-23H2,1-2H3,(H,36,37)(H,38,39)/t30?,31-/m0/s1