3a-azanyl-2-cyclohexyl-3-oxidanylidene-N1,N8b,4-tris(phenylmethyl)-1H-pyrrolo[3,4-b]indole-1,8b-dicarboxamide

Systemtic Name: 3a-azanyl-2-cyclohexyl-3-oxidanylidene-N1,N8b,4-tris(phenylmethyl)-1H-pyrrolo[3,4-b]indole-1,8b-dicarboxamide Openeye Name: 3a-amino-N1,N8b,4-tribenzyl-2-cyclohexyl-3-oxo-1H-pyrrolo[3,4-b]indole-1,8b-dicarboxamide CAS Name: 3a-amino-2-cyclohexyl-3-oxo-N1,N8b,4-tris(phenylmethyl)-1H-pyrrolo[3,4-b]indole-1,8b-dicarboxamide IUPAC Name: 3a-amino-1-N,8b-N,4-tribenzyl-2-cyclohexyl-3-oxo-1H-pyrrolo[3,4-b]indole-1,8b-dicarboxamide Traditional Name: 3a-amino-N,N',4-tribenzyl-2-cyclohexyl-3-keto-1H-pyrrol[3,4-b]indole-1,8b-dicarboxamide Formula: C39H41N5O3 MolecularWeight: 627.77454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(C3(C4=CC=CC=C4N(C3(C2=O)N)CC5=CC=CC=C5)C(=O)NCC6=CC=CC=C6)C(=O)NCC7=CC=CC=C7

Isomeric SMILES

C1CCC(CC1)N2C(C3(C4=CC=CC=C4N(C3(C2=O)N)CC5=CC=CC=C5)C(=O)NCC6=CC=CC=C6)C(=O)NCC7=CC=CC=C7

InChI

InChI=1S/C39H41N5O3/c40-39-37(47)44(31-21-11-4-12-22-31)34(35(45)41-25-28-15-5-1-6-16-28)38(39,36(46)42-26-29-17-7-2-8-18-29)32-23-13-14-24-33(32)43(39)27-30-19-9-3-10-20-30/h1-3,5-10,13-20,23-24,31,34H,4,11-12,21-22,25-27,40H2,(H,41,45)(H,42,46)