[5-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1-(hydroxymethyl)-1,4a-dimethyl-6-oxidanyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] N-phenylcarbamate

Systemtic Name: [5-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1-(hydroxymethyl)-1,4a-dimethyl-6-oxidanyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] N-phenylcarbamate Openeye Name: [5-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-decalin-2-yl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [5-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] ester IUPAC Name: [5-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [6-hydroxy-5-[2-keto-2-(piperonylamino)ethyl]-1,4a-dimethyl-1-methylol-decalin-2-yl] ester Formula: C30H38N2O7 MolecularWeight: 538.63192

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(C(C1CCC(C2CC(=O)NCC3=CC4=C(C=C3)OCO4)O)(C)CO)OC(=O)NC5=CC=CC=C5

Isomeric SMILES

CC12CCC(C(C1CCC(C2CC(=O)NCC3=CC4=C(C=C3)OCO4)O)(C)CO)OC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C30H38N2O7/c1-29-13-12-26(39-28(36)32-20-6-4-3-5-7-20)30(2,17-33)25(29)11-9-22(34)21(29)15-27(35)31-16-19-8-10-23-24(14-19)38-18-37-23/h3-8,10,14,21-22,25-26,33-34H,9,11-13,15-18H2,1-2H3,(H,31,35)(H,32,36)