(1R)-6-nitro-N-(1-phenethylpiperidin-1-ium-4-yl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine

Systemtic Name: (1R)-6-nitro-N-(1-phenethylpiperidin-1-ium-4-yl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine Openeye Name: (1R)-6-nitro-N-(1-phenethylpiperidin-1-ium-4-yl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine CAS Name: (1R)-6-nitro-N-(1-phenethyl-4-piperidin-1-iumyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine IUPAC Name: (1R)-6-nitro-N-(1-phenethylpiperidin-1-ium-4-yl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine Traditional Name: [(1R)-6-nitro-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-(1-phenethylpiperidin-1-ium-4-yl)amine Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)[N+](=O)[O-])NC4CC[NH+](CC4)CCC5=CC=CC=C5

Isomeric SMILES

C1C[C@H](C2=C(C1)C3=C(N2)C=CC(=C3)[N+](=O)[O-])NC4CC[NH+](CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C25H30N4O2/c30-29(31)20-9-10-23-22(17-20)21-7-4-8-24(25(21)27-23)26-19-12-15-28(16-13-19)14-11-18-5-2-1-3-6-18/h1-3,5-6,9-10,17,19,24,26-27H,4,7-8,11-16H2/p+1/t24-/m1/s1