4-[[8-(1,3-benzodioxol-5-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide

Systemtic Name: 4-[[8-(1,3-benzodioxol-5-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide Openeye Name: 4-[[8-(1,3-benzodioxol-5-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide CAS Name: 4-[[8-(1,3-benzodioxol-5-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[[8-(1,3-benzodioxol-5-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide Traditional Name: N,N-diethyl-4-[(3-hydroxyphenyl)-(8-piperonyl-8-azabicyclo[3.2.1]octan-3-ylidene)methyl]benzamide Formula: C33H36N2O4 MolecularWeight: 524.64994

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CC3CCC(C2)N3CC4=CC5=C(C=C4)OCO5)C6=CC(=CC=C6)O

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CC3CCC(C2)N3CC4=CC5=C(C=C4)OCO5)C6=CC(=CC=C6)O

InChI

InChI=1S/C33H36N2O4/c1-3-34(4-2)33(37)24-11-9-23(10-12-24)32(25-6-5-7-29(36)19-25)26-17-27-13-14-28(18-26)35(27)20-22-8-15-30-31(16-22)39-21-38-30/h5-12,15-16,19,27-28,36H,3-4,13-14,17-18,20-21H2,1-2H3