4-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]piperazine-1-carboxylic acid Openeye Name: 4-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]piperazine-1-carboxylic acid CAS Name: 4-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]piperazine-1-carboxylic acid Traditional Name: 4-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]piperazine-1-carboxylic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)C(=O)O

InChI

InChI=1S/C23H26N4O4/c1-3-31-18-10-8-17(9-11-18)27-21(24-20-7-5-4-6-19(20)22(27)28)16(2)25-12-14-26(15-13-25)23(29)30/h4-11,16H,3,12-15H2,1-2H3,(H,29,30)