2-methyl-5-nitro-N-[(4-nitrophenyl)-piperidin-1-ium-1-ylidene-methyl]aniline

Systemtic Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)-piperidin-1-ium-1-ylidene-methyl]aniline Openeye Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)-piperidin-1-ium-1-ylidene-methyl]aniline CAS Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)-(1-piperidin-1-iumylidene)methyl]aniline IUPAC Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)-piperidin-1-ium-1-ylidenemethyl]aniline Traditional Name: (2-methyl-5-nitro-phenyl)-[(4-nitrophenyl)-piperidin-1-ium-1-ylidene-methyl]amine Formula: C19H21N4O4+ MolecularWeight: 369.39444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=[N+]2CCCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=[N+]2CCCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4/c1-14-5-8-17(23(26)27)13-18(14)20-19(21-11-3-2-4-12-21)15-6-9-16(10-7-15)22(24)25/h5-10,13H,2-4,11-12H2,1H3/p+1