N-[1-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[homoveratryl(methyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C27H40N2O4 MolecularWeight: 456.6175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CCC1=CC(=C(C=C1)OC)OC)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)N(C)CCC1=CC(=C(C=C1)OC)OC)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H40N2O4/c1-17(2)24(28-26(31)27-14-19-10-20(15-27)12-21(11-19)16-27)25(30)29(3)9-8-18-6-7-22(32-4)23(13-18)33-5/h6-7,13,17,19-21,24H,8-12,14-16H2,1-5H3,(H,28,31)