N-(4-nitrophenyl)-N'-quinolin-1-ium-2-yl-ethane-1,2-diamine

Systemtic Name: N-(4-nitrophenyl)-N'-quinolin-1-ium-2-yl-ethane-1,2-diamine Openeye Name: N-(4-nitrophenyl)-N'-quinolin-1-ium-2-yl-ethane-1,2-diamine CAS Name: N-(4-nitrophenyl)-N'-(2-quinolin-1-iumyl)ethane-1,2-diamine IUPAC Name: N-(4-nitrophenyl)-N'-quinolin-1-ium-2-ylethane-1,2-diamine Traditional Name: 2-(4-nitroanilino)ethyl-quinolin-1-ium-2-yl-amine Formula: C17H17N4O2+ MolecularWeight: 309.34248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=[NH+]2)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=[NH+]2)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O2/c22-21(23)15-8-6-14(7-9-15)18-11-12-19-17-10-5-13-3-1-2-4-16(13)20-17/h1-10,18H,11-12H2,(H,19,20)/p+1