2,4-dinitro-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]aniline

Systemtic Name: 2,4-dinitro-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]aniline Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2,4-dinitro-aniline CAS Name: 2,4-dinitro-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]aniline IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2,4-dinitroaniline Traditional Name: [(1-benzylpiperidin-1-ium-4-ylidene)amino]-(2,4-dinitrophenyl)amine Formula: C18H20N5O4+ MolecularWeight: 370.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C18H19N5O4/c24-22(25)16-6-7-17(18(12-16)23(26)27)20-19-15-8-10-21(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,20H,8-11,13H2/p+1