8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole

Systemtic Name: 8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Openeye Name: 8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole CAS Name: 8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole IUPAC Name: 8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Traditional Name: 8,9-dimethyl-1-(3-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C3=C(CCO2)C=NN3C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C2C(=C1)C3=C(CCO2)C=NN3C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C19H17N3O3/c1-12-8-17-18(9-13(12)2)25-7-6-14-11-20-21(19(14)17)15-4-3-5-16(10-15)22(23)24/h3-5,8-11H,6-7H2,1-2H3