[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-(3-isopropoxypropyl)ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-(3-isopropoxypropyl)ammonium Formula: C16H27N2O4+ MolecularWeight: 311.39658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O4/c1-12(2)21-8-4-7-18-10-13-5-6-14(15(9-13)20-3)22-11-16(17)19/h5-6,9,12,18H,4,7-8,10-11H2,1-3H3,(H2,17,19)/p+1