methyl 2-[6-iodanyl-1-(1-methylindol-3-yl)-2,4-bis(oxidanylidene)quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[6-iodanyl-1-(1-methylindol-3-yl)-2,4-bis(oxidanylidene)quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[6-iodo-1-(1-methylindol-3-yl)-2,4-dioxo-quinazolin-3-yl]acetate CAS Name: 2-[6-iodo-1-(1-methyl-3-indolyl)-2,4-dioxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[6-iodo-1-(1-methylindol-3-yl)-2,4-dioxoquinazolin-3-yl]acetate Traditional Name: 2-[6-iodo-2,4-diketo-1-(1-methylindol-3-yl)quinazolin-3-yl]acetic acid methyl ester Formula: C20H16IN3O4 MolecularWeight: 489.26321

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)N3C4=C(C=C(C=C4)I)C(=O)N(C3=O)CC(=O)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)N3C4=C(C=C(C=C4)I)C(=O)N(C3=O)CC(=O)OC

InChI

InChI=1S/C20H16IN3O4/c1-22-10-17(13-5-3-4-6-15(13)22)24-16-8-7-12(21)9-14(16)19(26)23(20(24)27)11-18(25)28-2/h3-10H,11H2,1-2H3