2-phenylmethoxy-7-[[4-(phenylmethyl)piperidin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-phenylmethoxy-7-[[4-(phenylmethyl)piperidin-1-yl]methyl]-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-benzyloxy-7-[(4-benzyl-1-piperidyl)methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-phenylmethoxy-7-[[4-(phenylmethyl)-1-piperidinyl]methyl]-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[(4-benzylpiperidin-1-yl)methyl]-2-phenylmethoxy-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-benzoxy-7-[(4-benzylpiperidino)methyl]-4-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C30H35NO2 MolecularWeight: 441.6044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)OCC2=CC=CC=C2)CN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)OCC2=CC=CC=C2)CN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C30H35NO2/c1-23(2)27-13-14-28(30(32)29(20-27)33-22-26-11-7-4-8-12-26)21-31-17-15-25(16-18-31)19-24-9-5-3-6-10-24/h3-14,20,23,25H,15-19,21-22H2,1-2H3