2-[6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-(2,4-diketo-6,7-dimethoxy-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propionic acid Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)C(CC3=CNC4=CC=CC=C43)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)C(CC3=CNC4=CC=CC=C43)C(=O)O)OC

InChI

InChI=1S/C21H19N3O6/c1-29-17-8-13-15(9-18(17)30-2)23-21(28)24(19(13)25)16(20(26)27)7-11-10-22-14-6-4-3-5-12(11)14/h3-6,8-10,16,22H,7H2,1-2H3,(H,23,28)(H,26,27)