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

Systemtic Name: methyl 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[(2-p-phenetylpyrrolidino)methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H25N3O4/c1-3-30-17-9-6-15(7-10-17)20-5-4-12-26(20)14-21-24-19-13-16(23(28)29-2)8-11-18(19)22(27)25-21/h6-11,13,20H,3-5,12,14H2,1-2H3,(H,24,25,27)