4-[[2-azanylethyl-[(4,5-dimethoxy-2-nitro-phenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-azanylethyl-[(4,5-dimethoxy-2-nitro-phenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[2-aminoethyl-[(4,5-dimethoxy-2-nitro-phenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[2-aminoethyl-[(4,5-dimethoxy-2-nitrophenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[2-aminoethyl-[(4,5-dimethoxy-2-nitrophenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[2-aminoethyl-(4,5-dimethoxy-2-nitro-benzyl)amino]methyl]benzonitrile Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN(CCN)CC2=CC=C(C=C2)C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN(CCN)CC2=CC=C(C=C2)C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C19H22N4O4/c1-26-18-9-16(17(23(24)25)10-19(18)27-2)13-22(8-7-20)12-15-5-3-14(11-21)4-6-15/h3-6,9-10H,7-8,12-13,20H2,1-2H3