2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-oxidanyl-inden-1-one

Systemtic Name: 2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-oxidanyl-inden-1-one Openeye Name: 2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-hydroxy-inden-1-one CAS Name: 2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-hydroxy-1-indenone IUPAC Name: 2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-hydroxyinden-1-one Traditional Name: 2-[(3S,4S)-3-(2,3-dimethoxyphenyl)-4-phenyl-3,4-dihydropyridazin-6-yl]-3-hydroxy-inden-1-one Formula: C27H22N2O4 MolecularWeight: 438.47458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2C(C=C(N=N2)C3=C(C4=CC=CC=C4C3=O)O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)[C@@H]2[C@@H](C=C(N=N2)C3=C(C4=CC=CC=C4C3=O)O)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2O4/c1-32-22-14-8-13-19(27(22)33-2)24-20(16-9-4-3-5-10-16)15-21(28-29-24)23-25(30)17-11-6-7-12-18(17)26(23)31/h3-15,20,24,30H,1-2H3/t20-,24+/m0/s1