[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] N-[(3,4-dimethoxyphenyl)methyl]carbamate

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] N-[(3,4-dimethoxyphenyl)methyl]carbamate Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] N-[(3,4-dimethoxyphenyl)methyl]carbamate CAS Name: N-[(3,4-dimethoxyphenyl)methyl]carbamic acid [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] N-[(3,4-dimethoxyphenyl)methyl]carbamate Traditional Name: N-veratrylcarbamic acid [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)NCC2=CC(=C(C=C2)OC)OC)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)OC(=O)NCC2=CC(=C(C=C2)OC)OC)C(C)C

InChI

InChI=1S/C20H31NO4/c1-13(2)16-8-6-14(3)10-18(16)25-20(22)21-12-15-7-9-17(23-4)19(11-15)24-5/h7,9,11,13-14,16,18H,6,8,10,12H2,1-5H3,(H,21,22)/t14-,16+,18-/m0/s1