3-chloranyl-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[[4-[isopropyl(methyl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[[4-[[methyl(propan-2-yl)amino]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[[4-[methyl(propan-2-yl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[4-[isopropyl(methyl)carbamoyl]benzyl]adamantane-1-carboxamide Formula: C23H31ClN2O2 MolecularWeight: 402.95744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C(=O)C1=CC=C(C=C1)CNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

CC(C)N(C)C(=O)C1=CC=C(C=C1)CNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C23H31ClN2O2/c1-15(2)26(3)20(27)19-6-4-16(5-7-19)13-25-21(28)22-9-17-8-18(10-22)12-23(24,11-17)14-22/h4-7,15,17-18H,8-14H2,1-3H3,(H,25,28)