6-iodanyl-3-(4-methoxyphenyl)-2-[(Z)-[2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]methyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(4-methoxyphenyl)-2-[(Z)-[2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]methyl]quinazolin-4-one Openeye Name: 2-[(Z)-(1-benzyl-2-oxo-indolin-3-ylidene)methyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 6-iodo-3-(4-methoxyphenyl)-2-[(Z)-[2-oxo-1-(phenylmethyl)-3-indolylidene]methyl]-4-quinazolinone IUPAC Name: 2-[(Z)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[(Z)-(1-benzyl-2-keto-indolin-3-ylidene)methyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Formula: C31H22IN3O3 MolecularWeight: 611.42915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=C4C5=CC=CC=C5N(C4=O)CC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C\4/C5=CC=CC=C5N(C4=O)CC6=CC=CC=C6

InChI

InChI=1S/C31H22IN3O3/c1-38-23-14-12-22(13-15-23)35-29(33-27-16-11-21(32)17-26(27)31(35)37)18-25-24-9-5-6-10-28(24)34(30(25)36)19-20-7-3-2-4-8-20/h2-18H,19H2,1H3/b25-18-