methyl 3-(4-azanylbutoxy)-1-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: methyl 3-(4-azanylbutoxy)-1-oxidanyl-naphthalene-2-carboxylate Openeye Name: methyl 3-(4-aminobutoxy)-1-hydroxy-naphthalene-2-carboxylate CAS Name: 3-(4-aminobutoxy)-1-hydroxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-aminobutoxy)-1-hydroxynaphthalene-2-carboxylate Traditional Name: 3-(4-aminobutoxy)-1-hydroxy-naphthalene-2-carboxylic acid methyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2C=C1OCCCCN)O

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2C=C1OCCCCN)O

InChI

InChI=1S/C16H19NO4/c1-20-16(19)14-13(21-9-5-4-8-17)10-11-6-2-3-7-12(11)15(14)18/h2-3,6-7,10,18H,4-5,8-9,17H2,1H3