N-[(Z)-[2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-[2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-[2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(Z)-[2-(3-methyl-1-pyridin-1-iumyl)-1-(4-nitrophenyl)ethylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-[2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethylidene]amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(Z)-[2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethylidene]amino]amine Formula: C20H17N6O6+ MolecularWeight: 437.38558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C[N+](=CC=C1)C/C(=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N6O6/c1-14-3-2-10-23(12-14)13-19(15-4-6-16(7-5-15)24(27)28)22-21-18-9-8-17(25(29)30)11-20(18)26(31)32/h2-12,21H,13H2,1H3/q+1/b22-19+