4-(3-bromanyl-4-methoxy-phenyl)-2,7,7-trimethyl-3-piperidin-1-ylcarbonyl-1,4,4a,6-tetrahydroquinolin-5-one

Systemtic Name: 4-(3-bromanyl-4-methoxy-phenyl)-2,7,7-trimethyl-3-piperidin-1-ylcarbonyl-1,4,4a,6-tetrahydroquinolin-5-one Openeye Name: 4-(3-bromo-4-methoxy-phenyl)-2,7,7-trimethyl-3-(piperidine-1-carbonyl)-1,4,4a,6-tetrahydroquinolin-5-one CAS Name: 4-(3-bromo-4-methoxyphenyl)-2,7,7-trimethyl-3-[oxo(1-piperidinyl)methyl]-1,4,4a,6-tetrahydroquinolin-5-one IUPAC Name: 4-(3-bromo-4-methoxyphenyl)-2,7,7-trimethyl-3-(piperidine-1-carbonyl)-1,4,4a,6-tetrahydroquinolin-5-one Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-2,7,7-trimethyl-3-(piperidine-1-carbonyl)-1,4,4a,6-tetrahydroquinolin-5-one Formula: C25H31BrN2O3 MolecularWeight: 487.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC(=C(C=C3)OC)Br)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC(=C(C=C3)OC)Br)C(=O)N4CCCCC4

InChI

InChI=1S/C25H31BrN2O3/c1-15-21(24(30)28-10-6-5-7-11-28)22(16-8-9-20(31-4)17(26)12-16)23-18(27-15)13-25(2,3)14-19(23)29/h8-9,12-13,22-23,27H,5-7,10-11,14H2,1-4H3