1-(2-nitrophenyl)-5-(phenylmethyl)-1,2,5-triazepane

Systemtic Name: 1-(2-nitrophenyl)-5-(phenylmethyl)-1,2,5-triazepane Openeye Name: 5-benzyl-1-(2-nitrophenyl)-1,2,5-triazepane CAS Name: 1-(2-nitrophenyl)-5-(phenylmethyl)-1,2,5-triazepane IUPAC Name: 5-benzyl-1-(2-nitrophenyl)-1,2,5-triazepane Traditional Name: 5-benzyl-1-(2-nitrophenyl)-1,2,5-triazepane Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(N1)C2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(N1)C2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C17H20N4O2/c22-21(23)17-9-5-4-8-16(17)20-13-12-19(11-10-18-20)14-15-6-2-1-3-7-15/h1-9,18H,10-14H2