3a-azanyl-2-cyclohexyl-7-methoxy-3-oxidanylidene-N1,N8b-bis(phenylmethyl)-1,4-dihydropyrrolo[3,4-b]indole-1,8b-dicarboxamide

Systemtic Name: 3a-azanyl-2-cyclohexyl-7-methoxy-3-oxidanylidene-N1,N8b-bis(phenylmethyl)-1,4-dihydropyrrolo[3,4-b]indole-1,8b-dicarboxamide Openeye Name: 3a-amino-N1,N8b-dibenzyl-2-cyclohexyl-7-methoxy-3-oxo-1,4-dihydropyrrolo[3,4-b]indole-1,8b-dicarboxamide CAS Name: 3a-amino-2-cyclohexyl-7-methoxy-3-oxo-N1,N8b-bis(phenylmethyl)-1,4-dihydropyrrolo[3,4-b]indole-1,8b-dicarboxamide IUPAC Name: 3a-amino-1-N,8b-N-dibenzyl-2-cyclohexyl-7-methoxy-3-oxo-1,4-dihydropyrrolo[3,4-b]indole-1,8b-dicarboxamide Traditional Name: 3a-amino-N,N'-dibenzyl-2-cyclohexyl-3-keto-7-methoxy-1,4-dihydropyrrol[3,4-b]indole-1,8b-dicarboxamide Formula: C33H37N5O4 MolecularWeight: 567.67798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3(C2(C(N(C3=O)C4CCCCC4)C(=O)NCC5=CC=CC=C5)C(=O)NCC6=CC=CC=C6)N

Isomeric SMILES

COC1=CC2=C(C=C1)NC3(C2(C(N(C3=O)C4CCCCC4)C(=O)NCC5=CC=CC=C5)C(=O)NCC6=CC=CC=C6)N

InChI

InChI=1S/C33H37N5O4/c1-42-25-17-18-27-26(19-25)32(30(40)36-21-23-13-7-3-8-14-23)28(29(39)35-20-22-11-5-2-6-12-22)38(24-15-9-4-10-16-24)31(41)33(32,34)37-27/h2-3,5-8,11-14,17-19,24,28,37H,4,9-10,15-16,20-21,34H2,1H3,(H,35,39)(H,36,40)