methyl 4-[2-(2-cyclopentyloxyphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzoate

Systemtic Name: methyl 4-[2-(2-cyclopentyloxyphenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzoate Openeye Name: methyl 4-[2-[2-(cyclopentoxy)phenyl]-4-oxo-1,2-dihydroquinazolin-3-yl]benzoate CAS Name: 4-[2-(2-cyclopentyloxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2-cyclopentyloxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzoate Traditional Name: 4-[2-[2-(cyclopentoxy)phenyl]-4-keto-1,2-dihydroquinazolin-3-yl]benzoic acid methyl ester Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC=CC=C4OC5CCCC5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC=CC=C4OC5CCCC5

InChI

InChI=1S/C27H26N2O4/c1-32-27(31)18-14-16-19(17-15-18)29-25(28-23-12-6-4-10-21(23)26(29)30)22-11-5-7-13-24(22)33-20-8-2-3-9-20/h4-7,10-17,20,25,28H,2-3,8-9H2,1H3