methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]azanium

Systemtic Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]azanium Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]ammonium IUPAC Name: methyl-[[4-(methylcarbamoyl)phenyl]methyl]-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]azanium Traditional Name: [2-(3-isopropoxypropylamino)-2-keto-ethyl]-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C18H30N3O3+ MolecularWeight: 336.4491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C[NH+](C)CC1=CC=C(C=C1)C(=O)NC

Isomeric SMILES

CC(C)OCCCNC(=O)C[NH+](C)CC1=CC=C(C=C1)C(=O)NC

InChI

InChI=1S/C18H29N3O3/c1-14(2)24-11-5-10-20-17(22)13-21(4)12-15-6-8-16(9-7-15)18(23)19-3/h6-9,14H,5,10-13H2,1-4H3,(H,19,23)(H,20,22)/p+1