1-[6-bromanyl-2-methyl-1-(4-methylphenyl)-5-oxidanyl-4-(piperidin-1-ylmethyl)indol-3-yl]ethanone

Systemtic Name: 1-[6-bromanyl-2-methyl-1-(4-methylphenyl)-5-oxidanyl-4-(piperidin-1-ylmethyl)indol-3-yl]ethanone Openeye Name: 1-[6-bromo-5-hydroxy-2-methyl-4-(1-piperidylmethyl)-1-(p-tolyl)indol-3-yl]ethanone CAS Name: 1-[6-bromo-5-hydroxy-2-methyl-1-(4-methylphenyl)-4-(1-piperidinylmethyl)-3-indolyl]ethanone IUPAC Name: 1-[6-bromo-5-hydroxy-2-methyl-1-(4-methylphenyl)-4-(piperidin-1-ylmethyl)indol-3-yl]ethanone Traditional Name: 1-[6-bromo-5-hydroxy-2-methyl-4-(piperidinomethyl)-1-(p-tolyl)indol-3-yl]ethanone Formula: C24H27BrN2O2 MolecularWeight: 455.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C3=C(C(=C(C=C32)Br)O)CN4CCCCC4)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C3=C(C(=C(C=C32)Br)O)CN4CCCCC4)C(=O)C)C

InChI

InChI=1S/C24H27BrN2O2/c1-15-7-9-18(10-8-15)27-16(2)22(17(3)28)23-19(14-26-11-5-4-6-12-26)24(29)20(25)13-21(23)27/h7-10,13,29H,4-6,11-12,14H2,1-3H3