4-(azepan-1-yl)-2-phenyl-quinazoline chloride

Systemtic Name: 4-(azepan-1-yl)-2-phenyl-quinazoline chloride Openeye Name: 4-(azepan-1-yl)-2-phenyl-quinazoline chloride CAS Name: 4-(1-azepanyl)-2-phenylquinazoline chloride IUPAC Name: 4-(azepan-1-yl)-2-phenylquinazoline chloride Traditional Name: 4-(azepan-1-yl)-2-phenyl-quinazoline chloride Formula: C20H21ClN3- MolecularWeight: 338.85384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C20H21N3.ClH/c1-2-9-15-23(14-8-1)20-17-12-6-7-13-18(17)21-19(22-20)16-10-4-3-5-11-16;/h3-7,10-13H,1-2,8-9,14-15H2;1H/p-1