N-ethyl-11-[1-[(3-methoxy-4-oxidanyl-phenyl)methyl]piperidin-4-ylidene]-6H-benzo[c][1]benzoxepine-3-carboxamide

Systemtic Name: N-ethyl-11-[1-[(3-methoxy-4-oxidanyl-phenyl)methyl]piperidin-4-ylidene]-6H-benzo[c][1]benzoxepine-3-carboxamide Openeye Name: N-ethyl-11-[1-[(4-hydroxy-3-methoxy-phenyl)methyl]-4-piperidylidene]-6H-benzo[c][1]benzoxepine-3-carboxamide CAS Name: N-ethyl-11-[1-[(4-hydroxy-3-methoxyphenyl)methyl]-4-piperidinylidene]-6H-benzo[c][1]benzoxepin-3-carboxamide IUPAC Name: N-ethyl-11-[1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-ylidene]-6H-benzo[c][1]benzoxepine-3-carboxamide Traditional Name: N-ethyl-11-(1-vanillyl-4-piperidylidene)-6H-benzo[c][1]benzoxepin-3-carboxamide Formula: C30H32N2O4 MolecularWeight: 484.58608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC2=C(C=C1)C(=C3CCN(CC3)CC4=CC(=C(C=C4)O)OC)C5=CC=CC=C5CO2

Isomeric SMILES

CCNC(=O)C1=CC2=C(C=C1)C(=C3CCN(CC3)CC4=CC(=C(C=C4)O)OC)C5=CC=CC=C5CO2

InChI

InChI=1S/C30H32N2O4/c1-3-31-30(34)22-9-10-25-27(17-22)36-19-23-6-4-5-7-24(23)29(25)21-12-14-32(15-13-21)18-20-8-11-26(33)28(16-20)35-2/h4-11,16-17,33H,3,12-15,18-19H2,1-2H3,(H,31,34)