10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one

Systemtic Name: 10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one Openeye Name: 10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one CAS Name: 10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one IUPAC Name: 10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one Traditional Name: 10-methyl-5,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-10-ium-6-one Formula: C13H17N2O+ MolecularWeight: 217.28688

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCCC1C(=O)NC3=CC=CC=C3C2

Isomeric SMILES

C[N+]12CCCC1C(=O)NC3=CC=CC=C3C2

InChI

InChI=1S/C13H16N2O/c1-15-8-4-7-12(15)13(16)14-11-6-3-2-5-10(11)9-15/h2-3,5-6,12H,4,7-9H2,1H3/p+1