(5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone

Systemtic Name: (5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone Openeye Name: (5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone CAS Name: (5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone IUPAC Name: (5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone Traditional Name: (5-methyl-2,3,4,6-tetrahydro-1,5-benzodiazocin-1-yl)-(4-nitrophenyl)methanone Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3/c1-19-11-4-12-20(17-6-3-2-5-15(17)13-19)18(22)14-7-9-16(10-8-14)21(23)24/h2-3,5-10H,4,11-13H2,1H3