4-[(2-bromanyl-5-methoxy-phenyl)methyl]-3-oxidanyl-3-piperidin-1-yl-2-propyl-isoindol-1-one

Systemtic Name: 4-[(2-bromanyl-5-methoxy-phenyl)methyl]-3-oxidanyl-3-piperidin-1-yl-2-propyl-isoindol-1-one Openeye Name: 4-[(2-bromo-5-methoxy-phenyl)methyl]-3-hydroxy-3-(1-piperidyl)-2-propyl-isoindolin-1-one CAS Name: 4-[(2-bromo-5-methoxyphenyl)methyl]-3-hydroxy-3-(1-piperidinyl)-2-propyl-1-isoindolone IUPAC Name: 4-[(2-bromo-5-methoxyphenyl)methyl]-3-hydroxy-3-piperidin-1-yl-2-propylisoindol-1-one Traditional Name: 4-(2-bromo-5-methoxy-benzyl)-3-hydroxy-3-piperidino-2-propyl-isoindolin-1-one Formula: C24H29BrN2O3 MolecularWeight: 473.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1(N3CCCCC3)O)C(=CC=C2)CC4=C(C=CC(=C4)OC)Br

Isomeric SMILES

CCCN1C(=O)C2=C(C1(N3CCCCC3)O)C(=CC=C2)CC4=C(C=CC(=C4)OC)Br

InChI

InChI=1S/C24H29BrN2O3/c1-3-12-27-23(28)20-9-7-8-17(15-18-16-19(30-2)10-11-21(18)25)22(20)24(27,29)26-13-5-4-6-14-26/h7-11,16,29H,3-6,12-15H2,1-2H3