N-(3-methylcinnolin-5-yl)-5-nitro-spiro[benzimidazole-2,1'-cyclohexane]-4-amine

Systemtic Name: N-(3-methylcinnolin-5-yl)-5-nitro-spiro[benzimidazole-2,1'-cyclohexane]-4-amine Openeye Name: N-(3-methylcinnolin-5-yl)-5-nitro-spiro[benzimidazole-2,1'-cyclohexane]-4-amine CAS Name: N-(3-methyl-5-cinnolinyl)-5-nitro-4-spiro[benzimidazole-2,1'-cyclohexane]amine IUPAC Name: N-(3-methylcinnolin-5-yl)-5-nitrospiro[benzimidazole-2,1'-cyclohexane]-4-amine Traditional Name: (3-methylcinnolin-5-yl)-(5-nitrospiro[benzimidazole-2,1'-cyclohexane]-4-yl)amine Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2C=CC=C(C2=C1)NC3=C(C=CC4=NC5(CCCCC5)N=C43)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C2C=CC=C(C2=C1)NC3=C(C=CC4=NC5(CCCCC5)N=C43)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O2/c1-13-12-14-15(6-5-7-16(14)26-25-13)22-20-18(27(28)29)9-8-17-19(20)24-21(23-17)10-3-2-4-11-21/h5-9,12,22H,2-4,10-11H2,1H3