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

Systemtic Name: N-[1-[[3-(diethylaminomethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[[3-(diethylaminomethyl)phenyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[3-(diethylaminomethyl)anilino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[3-(diethylaminomethyl)anilino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[[3-(diethylaminomethyl)phenyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C27H41N3O2 MolecularWeight: 439.63334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)NC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)NC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H41N3O2/c1-5-30(6-2)17-19-8-7-9-23(13-19)28-25(31)24(18(3)4)29-26(32)27-14-20-10-21(15-27)12-22(11-20)16-27/h7-9,13,18,20-22,24H,5-6,10-12,14-17H2,1-4H3,(H,28,31)(H,29,32)