3-(6-methoxy-5-nitro-pyrimidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-(6-methoxy-5-nitro-pyrimidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-(6-methoxy-5-nitro-pyrimidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-(6-methoxy-5-nitro-4-pyrimidinyl)-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-(6-methoxy-5-nitropyrimidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-(6-methoxy-5-nitro-pyrimidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepine Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3CC2

Isomeric SMILES

COC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C15H16N4O3/c1-22-15-13(19(20)21)14(16-10-17-15)18-8-6-11-4-2-3-5-12(11)7-9-18/h2-5,10H,6-9H2,1H3