2-acetamidoethyl-[(3-ethoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 2-acetamidoethyl-[(3-ethoxy-4-oxidanyl-phenyl)methyl]azanium Openeye Name: 2-acetamidoethyl-[(3-ethoxy-4-hydroxy-phenyl)methyl]ammonium CAS Name: 2-acetamidoethyl-[(3-ethoxy-4-hydroxyphenyl)methyl]ammonium IUPAC Name: 2-acetamidoethyl-[(3-ethoxy-4-hydroxyphenyl)methyl]azanium Traditional Name: 2-acetamidoethyl-(3-ethoxy-4-hydroxy-benzyl)ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCNC(=O)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCNC(=O)C)O

InChI

InChI=1S/C13H20N2O3/c1-3-18-13-8-11(4-5-12(13)17)9-14-6-7-15-10(2)16/h4-5,8,14,17H,3,6-7,9H2,1-2H3,(H,15,16)/p+1