1-(2-chloranyl-5-nitro-phenyl)-N-methyl-N-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]methanamine

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-N-methyl-N-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]methanamine Openeye Name: 1-(2-chloro-5-nitro-phenyl)-N-methyl-N-[(1-phenyltetrazol-5-yl)methyl]methanamine CAS Name: 1-(2-chloro-5-nitrophenyl)-N-methyl-N-[(1-phenyl-5-tetrazolyl)methyl]methanamine IUPAC Name: 1-(2-chloro-5-nitrophenyl)-N-methyl-N-[(1-phenyltetrazol-5-yl)methyl]methanamine Traditional Name: (2-chloro-5-nitro-benzyl)-methyl-[(1-phenyltetrazol-5-yl)methyl]amine Formula: C16H15ClN6O2 MolecularWeight: 358.7823

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H15ClN6O2/c1-21(10-12-9-14(23(24)25)7-8-15(12)17)11-16-18-19-20-22(16)13-5-3-2-4-6-13/h2-9H,10-11H2,1H3