methyl 2-[[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidinyl]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[4-(2-p-phenetylethyl)piperidino]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H31N3O4/c1-3-33-21-9-6-18(7-10-21)4-5-19-12-14-29(15-13-19)17-24-27-23-16-20(26(31)32-2)8-11-22(23)25(30)28-24/h6-11,16,19H,3-5,12-15,17H2,1-2H3,(H,27,28,30)