[4-(6-bromanylquinazolin-4-yl)piperidin-1-yl] 2-methylbenzoate

Systemtic Name: [4-(6-bromanylquinazolin-4-yl)piperidin-1-yl] 2-methylbenzoate Openeye Name: [4-(6-bromoquinazolin-4-yl)-1-piperidyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-(6-bromo-4-quinazolinyl)-1-piperidinyl] ester IUPAC Name: [4-(6-bromoquinazolin-4-yl)piperidin-1-yl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-(6-bromoquinazolin-4-yl)piperidino] ester Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)ON2CCC(CC2)C3=NC=NC4=C3C=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)ON2CCC(CC2)C3=NC=NC4=C3C=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O2/c1-14-4-2-3-5-17(14)21(26)27-25-10-8-15(9-11-25)20-18-12-16(22)6-7-19(18)23-13-24-20/h2-7,12-13,15H,8-11H2,1H3