[2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] ethanoate

Systemtic Name: [2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] ethanoate Openeye Name: [2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] acetate CAS Name: acetic acid [2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] ester IUPAC Name: [2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] acetate Traditional Name: acetic acid [2-(3-bromophenyl)-3,3,6-trimethyl-2,4-dihydro-1H-quinolin-4-yl] ester Formula: C20H22BrNO2 MolecularWeight: 388.29818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(C(C2OC(=O)C)(C)C)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC2=C(C=C1)NC(C(C2OC(=O)C)(C)C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H22BrNO2/c1-12-8-9-17-16(10-12)19(24-13(2)23)20(3,4)18(22-17)14-6-5-7-15(21)11-14/h5-11,18-19,22H,1-4H3