1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]methyl]-2,3-dimethyl-N-methylsulfonyl-cyclopropane-1-carboxamide

Systemtic Name: 1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]methyl]-2,3-dimethyl-N-methylsulfonyl-cyclopropane-1-carboxamide Openeye Name: 1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidyl]methyl]-2,3-dimethyl-N-methylsulfonyl-cyclopropanecarboxamide CAS Name: 1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidinyl]methyl]-2,3-dimethyl-N-methylsulfonyl-1-cyclopropanecarboxamide IUPAC Name: 1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]methyl]-2,3-dimethyl-N-methylsulfonylcyclopropane-1-carboxamide Traditional Name: N-mesyl-1-[[4-(8-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)piperidino]methyl]-2,3-dimethyl-cyclopropanecarboxamide Formula: C28H34N2O5S MolecularWeight: 510.64496

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C1(CN2CCC(=C3C4=C(COC5=CC=CC=C53)C=C(C=C4)OC)CC2)C(=O)NS(=O)(=O)C)C

Isomeric SMILES

CC1C(C1(CN2CCC(=C3C4=C(COC5=CC=CC=C53)C=C(C=C4)OC)CC2)C(=O)NS(=O)(=O)C)C

InChI

InChI=1S/C28H34N2O5S/c1-18-19(2)28(18,27(31)29-36(4,32)33)17-30-13-11-20(12-14-30)26-23-10-9-22(34-3)15-21(23)16-35-25-8-6-5-7-24(25)26/h5-10,15,18-19H,11-14,16-17H2,1-4H3,(H,29,31)