3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine

Systemtic Name: 3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine Openeye Name: 3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine CAS Name: 3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine IUPAC Name: 3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine Traditional Name: 3,3,5,5-tetramethyl-2-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-1,4-dihydro-2-benzazepine Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N(CC2=CC=CC=C21)C3=NC(=NN3C)[N+](=O)[O-])(C)C)C

Isomeric SMILES

CC1(CC(N(CC2=CC=CC=C21)C3=NC(=NN3C)[N+](=O)[O-])(C)C)C

InChI

InChI=1S/C17H23N5O2/c1-16(2)11-17(3,4)21(10-12-8-6-7-9-13(12)16)15-18-14(22(23)24)19-20(15)5/h6-9H,10-11H2,1-5H3