tert-butyl N-[6-cyano-1,6-bis(3,4-dimethoxyphenyl)-7-methyl-octan-2-yl]carbamate

Systemtic Name: tert-butyl N-[6-cyano-1,6-bis(3,4-dimethoxyphenyl)-7-methyl-octan-2-yl]carbamate Openeye Name: tert-butyl N-[5-cyano-5-(3,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-6-methyl-heptyl]carbamate CAS Name: N-[6-cyano-1,6-bis(3,4-dimethoxyphenyl)-7-methyloctan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-cyano-1,6-bis(3,4-dimethoxyphenyl)-7-methyloctan-2-yl]carbamate Traditional Name: N-[5-cyano-5-(3,4-dimethoxyphenyl)-6-methyl-1-veratryl-heptyl]carbamic acid tert-butyl ester Formula: C31H44N2O6 MolecularWeight: 540.69086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CC1=CC(=C(C=C1)OC)OC)NC(=O)OC(C)(C)C)(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C(CCCC(CC1=CC(=C(C=C1)OC)OC)NC(=O)OC(C)(C)C)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C31H44N2O6/c1-21(2)31(20-32,23-13-15-26(36-7)28(19-23)38-9)16-10-11-24(33-29(34)39-30(3,4)5)17-22-12-14-25(35-6)27(18-22)37-8/h12-15,18-19,21,24H,10-11,16-17H2,1-9H3,(H,33,34)