(3-ethoxy-4-propan-2-yloxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium

Systemtic Name: (3-ethoxy-4-propan-2-yloxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Openeye Name: (3-ethoxy-4-isopropoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium CAS Name: (3-ethoxy-4-propan-2-yloxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium IUPAC Name: (3-ethoxy-4-propan-2-yloxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Traditional Name: (3-ethoxy-4-isopropoxy-benzyl)-[2-(2-hydroxyethylamino)ethyl]ammonium Formula: C16H29N2O3+ MolecularWeight: 297.41306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCNCCO)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCNCCO)OC(C)C

InChI

InChI=1S/C16H28N2O3/c1-4-20-16-11-14(5-6-15(16)21-13(2)3)12-18-8-7-17-9-10-19/h5-6,11,13,17-19H,4,7-10,12H2,1-3H3/p+1