[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-(1,1,3,3-tetramethylbutyl)ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-(1,1,3,3-tetramethylbutyl)ammonium Formula: C18H31N2O3+ MolecularWeight: 323.45034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)[NH2+]CC1=CC(=C(C=C1)OCC(=O)N)OC

Isomeric SMILES

CC(C)(C)CC(C)(C)[NH2+]CC1=CC(=C(C=C1)OCC(=O)N)OC

InChI

InChI=1S/C18H30N2O3/c1-17(2,3)12-18(4,5)20-10-13-7-8-14(15(9-13)22-6)23-11-16(19)21/h7-9,20H,10-12H2,1-6H3,(H2,19,21)/p+1