2-azanyl-3-(1H-indol-3-yl)-3-[(4-phenylphenyl)methyl]-2-(propanoylamino)hexanoic acid

Systemtic Name: 2-azanyl-3-(1H-indol-3-yl)-3-[(4-phenylphenyl)methyl]-2-(propanoylamino)hexanoic acid Openeye Name: 2-amino-3-(1H-indol-3-yl)-3-[(4-phenylphenyl)methyl]-2-(propanoylamino)hexanoic acid CAS Name: 2-amino-3-(1H-indol-3-yl)-2-(1-oxopropylamino)-3-[(4-phenylphenyl)methyl]hexanoic acid IUPAC Name: 2-amino-3-(1H-indol-3-yl)-3-[(4-phenylphenyl)methyl]-2-(propanoylamino)hexanoic acid Traditional Name: 2-amino-3-(1H-indol-3-yl)-3-(4-phenylbenzyl)-2-propionamido-hexanoic acid Formula: C30H33N3O3 MolecularWeight: 483.60132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=C(C=C1)C2=CC=CC=C2)(C3=CNC4=CC=CC=C43)C(C(=O)O)(N)NC(=O)CC

Isomeric SMILES

CCCC(CC1=CC=C(C=C1)C2=CC=CC=C2)(C3=CNC4=CC=CC=C43)C(C(=O)O)(N)NC(=O)CC

InChI

InChI=1S/C30H33N3O3/c1-3-18-29(30(31,28(35)36)33-27(34)4-2,25-20-32-26-13-9-8-12-24(25)26)19-21-14-16-23(17-15-21)22-10-6-5-7-11-22/h5-17,20,32H,3-4,18-19,31H2,1-2H3,(H,33,34)(H,35,36)