[4-[(4-phenylazanylquinazolin-2-yl)amino]cyclohexyl] ethanoate hydrochloride

Systemtic Name: [4-[(4-phenylazanylquinazolin-2-yl)amino]cyclohexyl] ethanoate hydrochloride Openeye Name: [4-[(4-anilinoquinazolin-2-yl)amino]cyclohexyl] acetate hydrochloride CAS Name: acetic acid [4-[(4-anilino-2-quinazolinyl)amino]cyclohexyl] ester hydrochloride IUPAC Name: [4-[(4-anilinoquinazolin-2-yl)amino]cyclohexyl] acetate hydrochloride Traditional Name: acetic acid [4-[(4-anilinoquinazolin-2-yl)amino]cyclohexyl] ester hydrochloride Formula: C22H25ClN4O2 MolecularWeight: 412.9125

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(CC1)NC2=NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4.Cl

Isomeric SMILES

CC(=O)OC1CCC(CC1)NC2=NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4.Cl

InChI

InChI=1S/C22H24N4O2.ClH/c1-15(27)28-18-13-11-17(12-14-18)24-22-25-20-10-6-5-9-19(20)21(26-22)23-16-7-3-2-4-8-16;/h2-10,17-18H,11-14H2,1H3,(H2,23,24,25,26);1H