methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]propanoate Openeye Name: methyl 2-[[2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[3-methyl-2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-1-oxopentyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoyl]amino]propanoate Traditional Name: 2-[[2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C32H42N4O6 MolecularWeight: 578.69908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)C(C(C)CC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)C(C(C)CC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C32H42N4O6/c1-6-20(3)27(29(37)34-26(31(39)41-5)17-23-18-33-25-16-12-11-15-24(23)25)35-30(38)28(21(4)7-2)36-32(40)42-19-22-13-9-8-10-14-22/h8-16,18,20-21,26-28,33H,6-7,17,19H2,1-5H3,(H,34,37)(H,35,38)(H,36,40)