3-[2-(2-bromophenyl)carbonyl-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one

Systemtic Name: 3-[2-(2-bromophenyl)carbonyl-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one Openeye Name: 3-[2-(2-bromobenzoyl)-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one CAS Name: 3-[2-[(2-bromophenyl)-oxomethyl]-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one IUPAC Name: 3-[2-(2-bromobenzoyl)-3-(3,4-dimethoxyphenyl)-3,4-dihydropyrazol-5-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one Traditional Name: 3-[1-(2-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-2-pyrazolin-3-yl]-6-nitro-4-phenyl-4a,8a-dihydro-1H-quinolin-2-one Formula: C33H27BrN4O6 MolecularWeight: 655.49468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3Br)C4=C(C5C=C(C=CC5NC4=O)[N+](=O)[O-])C6=CC=CC=C6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3Br)C4=C(C5C=C(C=CC5NC4=O)[N+](=O)[O-])C6=CC=CC=C6)OC

InChI

InChI=1S/C33H27BrN4O6/c1-43-28-15-12-20(16-29(28)44-2)27-18-26(36-37(27)33(40)22-10-6-7-11-24(22)34)31-30(19-8-4-3-5-9-19)23-17-21(38(41)42)13-14-25(23)35-32(31)39/h3-17,23,25,27H,18H2,1-2H3,(H,35,39)