4-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-3-nitro-benzonitrile CAS Name: 4-[(2-chloro-5-nitrophenyl)methyl-methylamino]-3-nitrobenzonitrile IUPAC Name: 4-[(2-chloro-5-nitrophenyl)methyl-methylamino]-3-nitrobenzonitrile Traditional Name: 4-[(2-chloro-5-nitro-benzyl)-methyl-amino]-3-nitro-benzonitrile Formula: C15H11ClN4O4 MolecularWeight: 346.72524

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN4O4/c1-18(9-11-7-12(19(21)22)3-4-13(11)16)14-5-2-10(8-17)6-15(14)20(23)24/h2-7H,9H2,1H3