9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole

Systemtic Name: 9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Openeye Name: 9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole CAS Name: 9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole IUPAC Name: 9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Traditional Name: 9-methyl-1-(4-nitrophenyl)-4,5-dihydro-[1]benzoxepino[5,4-c]pyrazole Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCCC3=C2N(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OCCC3=C2N(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3/c1-12-2-7-17-16(10-12)18-13(8-9-24-17)11-19-20(18)14-3-5-15(6-4-14)21(22)23/h2-7,10-11H,8-9H2,1H3