[4-[(5R,5aR,8aR)-6-oxidanylidene-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxy-phenyl] N-(2-chloroethyl)carbamate

Systemtic Name: [4-[(5R,5aR,8aR)-6-oxidanylidene-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxy-phenyl] N-(2-chloroethyl)carbamate Openeye Name: [4-[(5R,5aR,8aR)-6-oxo-5a,8,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxy-phenyl] N-(2-chloroethyl)carbamate CAS Name: N-(2-chloroethyl)carbamic acid [4-[(5R,5aR,8aR)-6-oxo-5a,8,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxyphenyl] ester IUPAC Name: [4-[(5R,5aR,8aR)-6-oxo-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxyphenyl] N-(2-chloroethyl)carbamate Traditional Name: N-(2-chloroethyl)carbamic acid [4-[(5R,5aR,8aR)-6-keto-5a,8,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-5-yl]-2,6-dimethoxy-phenyl] ester Formula: C24H24ClNO8 MolecularWeight: 489.90226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC(=O)NCCCl)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O

Isomeric SMILES

COC1=CC(=CC(=C1OC(=O)NCCCl)OC)[C@H]2[C@@H]3[C@@H](CC4=CC5=C(C=C24)OCO5)COC3=O

InChI

InChI=1S/C24H24ClNO8/c1-29-18-7-13(8-19(30-2)22(18)34-24(28)26-4-3-25)20-15-9-17-16(32-11-33-17)6-12(15)5-14-10-31-23(27)21(14)20/h6-9,14,20-21H,3-5,10-11H2,1-2H3,(H,26,28)/t14-,20+,21-/m0/s1