N-[(2R)-1-[[2-(diethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-1-[[2-(diethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-1-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-1-[[2-(diethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-1-[[2-(diethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-1-[[2-(diethylaminomethyl)benzyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C28H43N3O2 MolecularWeight: 453.65992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)[C@@H](C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C28H43N3O2/c1-5-31(6-2)18-24-10-8-7-9-23(24)17-29-26(32)25(19(3)4)30-27(33)28-14-20-11-21(15-28)13-22(12-20)16-28/h7-10,19-22,25H,5-6,11-18H2,1-4H3,(H,29,32)(H,30,33)/t20?,21?,22?,25-,28?/m1/s1