(1-methyl-5-nitro-3-phenyl-indol-2-yl)methyl-(phenylmethyl)azanium

Systemtic Name: (1-methyl-5-nitro-3-phenyl-indol-2-yl)methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(1-methyl-5-nitro-3-phenyl-indol-2-yl)methyl]ammonium CAS Name: (1-methyl-5-nitro-3-phenyl-2-indolyl)methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(1-methyl-5-nitro-3-phenylindol-2-yl)methyl]azanium Traditional Name: benzyl-[(1-methyl-5-nitro-3-phenyl-indol-2-yl)methyl]ammonium Formula: C23H22N3O2+ MolecularWeight: 372.43968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=C1C[NH2+]CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=C1C[NH2+]CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2/c1-25-21-13-12-19(26(27)28)14-20(21)23(18-10-6-3-7-11-18)22(25)16-24-15-17-8-4-2-5-9-17/h2-14,24H,15-16H2,1H3/p+1