4-[(1-methyl-6-nitro-quinolin-1-ium-4-yl)amino]-2-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide

Systemtic Name: 4-[(1-methyl-6-nitro-quinolin-1-ium-4-yl)amino]-2-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide Openeye Name: 4-[(1-methyl-6-nitro-quinolin-1-ium-4-yl)amino]-2-nitro-N-[4-(4-pyridylamino)phenyl]benzamide CAS Name: 4-[(1-methyl-6-nitro-4-quinolin-1-iumyl)amino]-2-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide IUPAC Name: 4-[(1-methyl-6-nitroquinolin-1-ium-4-yl)amino]-2-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide Traditional Name: 4-[(1-methyl-6-nitro-quinolin-1-ium-4-yl)amino]-2-nitro-N-[4-(4-pyridylamino)phenyl]benzamide Formula: C28H22N7O5+ MolecularWeight: 536.51818

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC(=CC2=C(C=C1)NC3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=NC=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[N+]1=C2C=CC(=CC2=C(C=C1)NC3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=NC=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C28H21N7O5/c1-33-15-12-25(24-17-22(34(37)38)7-9-26(24)33)31-21-6-8-23(27(16-21)35(39)40)28(36)32-19-4-2-18(3-5-19)30-20-10-13-29-14-11-20/h2-17H,1H3,(H2,29,30,32,36)/p+1