4-[(phenylmethyl)amino]quinazoline-5-carboxylic acid hydrochloride

Systemtic Name: 4-[(phenylmethyl)amino]quinazoline-5-carboxylic acid hydrochloride Openeye Name: 4-(benzylamino)quinazoline-5-carboxylic acid hydrochloride CAS Name: 4-[(phenylmethyl)amino]-5-quinazolinecarboxylic acid hydrochloride IUPAC Name: 4-(benzylamino)quinazoline-5-carboxylic acid hydrochloride Traditional Name: 4-(benzylamino)quinazoline-5-carboxylic acid hydrochloride Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=NC3=CC=CC(=C32)C(=O)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=NC3=CC=CC(=C32)C(=O)O.Cl

InChI

InChI=1S/C16H13N3O2.ClH/c20-16(21)12-7-4-8-13-14(12)15(19-10-18-13)17-9-11-5-2-1-3-6-11;/h1-8,10H,9H2,(H,20,21)(H,17,18,19);1H