(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(3-bromo-5-ethoxy-4-methoxy-phenyl)methanone CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(3-bromo-5-ethoxy-4-methoxyphenyl)methanone Traditional Name: (4-benzylpiperidino)-(3-bromo-5-ethoxy-4-methoxy-phenyl)methanone Formula: C22H26BrNO3 MolecularWeight: 432.35074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)Br)OC

InChI

InChI=1S/C22H26BrNO3/c1-3-27-20-15-18(14-19(23)21(20)26-2)22(25)24-11-9-17(10-12-24)13-16-7-5-4-6-8-16/h4-8,14-15,17H,3,9-13H2,1-2H3