(2S)-2-[1,3-benzodioxol-5-ylmethyl-[2-(1H-indol-3-yl)ethanoyl]amino]-N-cyclohexyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl-[2-(1H-indol-3-yl)ethanoyl]amino]-N-cyclohexyl-2-phenyl-ethanamide Openeye Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl-[2-(1H-indol-3-yl)acetyl]amino]-N-cyclohexyl-2-phenyl-acetamide CAS Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl-[2-(1H-indol-3-yl)-1-oxoethyl]amino]-N-cyclohexyl-2-phenylacetamide IUPAC Name: (2S)-2-[1,3-benzodioxol-5-ylmethyl-[2-(1H-indol-3-yl)acetyl]amino]-N-cyclohexyl-2-phenylacetamide Traditional Name: (2S)-N-cyclohexyl-2-[[2-(1H-indol-3-yl)acetyl]-piperonyl-amino]-2-phenyl-acetamide Formula: C32H33N3O4 MolecularWeight: 523.62212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CC5=CNC6=CC=CC=C65

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@H](C2=CC=CC=C2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CC5=CNC6=CC=CC=C65

InChI

InChI=1S/C32H33N3O4/c36-30(18-24-19-33-27-14-8-7-13-26(24)27)35(20-22-15-16-28-29(17-22)39-21-38-28)31(23-9-3-1-4-10-23)32(37)34-25-11-5-2-6-12-25/h1,3-4,7-10,13-17,19,25,31,33H,2,5-6,11-12,18,20-21H2,(H,34,37)/t31-/m0/s1