2-[1-[(1-methylindol-3-yl)methyl]-2,4-bis(oxidanylidene)-6-pentyl-quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(1-methylindol-3-yl)methyl]-2,4-bis(oxidanylidene)-6-pentyl-quinazolin-3-yl]ethanoic acid Openeye Name: 2-[1-[(1-methylindol-3-yl)methyl]-2,4-dioxo-6-pentyl-quinazolin-3-yl]acetic acid CAS Name: 2-[1-[(1-methyl-3-indolyl)methyl]-2,4-dioxo-6-pentyl-3-quinazolinyl]acetic acid IUPAC Name: 2-[1-[(1-methylindol-3-yl)methyl]-2,4-dioxo-6-pentylquinazolin-3-yl]acetic acid Traditional Name: 2-[6-amyl-2,4-diketo-1-[(1-methylindol-3-yl)methyl]quinazolin-3-yl]acetic acid Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)N(C(=O)N(C2=O)CC(=O)O)CC3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)N(C(=O)N(C2=O)CC(=O)O)CC3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C25H27N3O4/c1-3-4-5-8-17-11-12-22-20(13-17)24(31)28(16-23(29)30)25(32)27(22)15-18-14-26(2)21-10-7-6-9-19(18)21/h6-7,9-14H,3-5,8,15-16H2,1-2H3,(H,29,30)