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

Systemtic Name: methyl 3-[4-oxidanylidene-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-2-yl]benzoate Openeye Name: methyl 3-[4-oxo-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-2-yl]benzoate CAS Name: 3-[4-oxo-1-[2-(4-phenyl-1-piperazinyl)ethyl]-2,3-dihydroquinazolin-2-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-1-[2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydroquinazolin-2-yl]benzoate Traditional Name: 3-[4-keto-1-[2-(4-phenylpiperazino)ethyl]-2,3-dihydroquinazolin-2-yl]benzoic acid methyl ester Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C2NC(=O)C3=CC=CC=C3N2CCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C2NC(=O)C3=CC=CC=C3N2CCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O3/c1-35-28(34)22-9-7-8-21(20-22)26-29-27(33)24-12-5-6-13-25(24)32(26)19-16-30-14-17-31(18-15-30)23-10-3-2-4-11-23/h2-13,20,26H,14-19H2,1H3,(H,29,33)