2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one

Systemtic Name: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one Openeye Name: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one CAS Name: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one IUPAC Name: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one Traditional Name: 2-cyclohexyl-4-phenyl-3,3a,4,5-tetrahydropyrrolo[3,4-c][1,5]benzodiazepin-1-one Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3C(NC4=CC=CC=C4N=C3C2=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2CC3C(NC4=CC=CC=C4N=C3C2=O)C5=CC=CC=C5

InChI

InChI=1S/C23H25N3O/c27-23-22-18(15-26(23)17-11-5-2-6-12-17)21(16-9-3-1-4-10-16)24-19-13-7-8-14-20(19)25-22/h1,3-4,7-10,13-14,17-18,21,24H,2,5-6,11-12,15H2