(phenylmethyl) (2S)-2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-pentanoyl]amino]-3-(5-methyl-1H-indol-3-yl)propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-pentanoyl]amino]-3-(5-methyl-1H-indol-3-yl)propanoate Openeye Name: benzyl (2S)-2-[[(2S)-2-(dibenzyloxyphosphorylmethylamino)-4-methyl-pentanoyl]amino]-3-(5-methyl-1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methyl-1-oxopentyl]amino]-3-(5-methyl-1H-indol-3-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2S)-2-[bis(phenylmethoxy)phosphorylmethylamino]-4-methylpentanoyl]amino]-3-(5-methyl-1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[[(2S)-2-(dibenzoxyphosphorylmethylamino)-4-methyl-pentanoyl]amino]-3-(5-methyl-1H-indol-3-yl)propionic acid benzyl ester Formula: C40H46N3O6P MolecularWeight: 695.783501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC=C2CC(C(=O)OCC3=CC=CC=C3)NC(=O)C(CC(C)C)NCP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)NC=C2C[C@@H](C(=O)OCC3=CC=CC=C3)NC(=O)[C@H](CC(C)C)NCP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C40H46N3O6P/c1-29(2)21-37(42-28-50(46,48-26-32-15-9-5-10-16-32)49-27-33-17-11-6-12-18-33)39(44)43-38(40(45)47-25-31-13-7-4-8-14-31)23-34-24-41-36-20-19-30(3)22-35(34)36/h4-20,22,24,29,37-38,41-42H,21,23,25-28H2,1-3H3,(H,43,44)/t37-,38-/m0/s1