4-[3-[2-(bromomethyl)-8-methoxy-4-oxidanylidene-quinazolin-3-yl]propyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[3-[2-(bromomethyl)-8-methoxy-4-oxidanylidene-quinazolin-3-yl]propyl]piperidine-1-carboxylic acid Openeye Name: 4-[3-[2-(bromomethyl)-8-methoxy-4-oxo-quinazolin-3-yl]propyl]piperidine-1-carboxylic acid CAS Name: 4-[3-[2-(bromomethyl)-8-methoxy-4-oxo-3-quinazolinyl]propyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[3-[2-(bromomethyl)-8-methoxy-4-oxoquinazolin-3-yl]propyl]piperidine-1-carboxylic acid Traditional Name: 4-[3-[2-(bromomethyl)-4-keto-8-methoxy-quinazolin-3-yl]propyl]piperidine-1-carboxylic acid Formula: C19H24BrN3O4 MolecularWeight: 438.31556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(N(C2=O)CCCC3CCN(CC3)C(=O)O)CBr

Isomeric SMILES

COC1=CC=CC2=C1N=C(N(C2=O)CCCC3CCN(CC3)C(=O)O)CBr

InChI

InChI=1S/C19H24BrN3O4/c1-27-15-6-2-5-14-17(15)21-16(12-20)23(18(14)24)9-3-4-13-7-10-22(11-8-13)19(25)26/h2,5-6,13H,3-4,7-12H2,1H3,(H,25,26)