3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-(2-cyclopropyl-5-nitro-1,2-dihydropyrimidin-6-yl)-1,2,4,5-tetrahydro-3-benzazepine Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2NC(=C(C=N2)[N+](=O)[O-])N3CCC4=CC=CC=C4CC3

Isomeric SMILES

C1CC1C2NC(=C(C=N2)[N+](=O)[O-])N3CCC4=CC=CC=C4CC3

InChI

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