3-phenylbutyl 5-azanyl-2-oxidanyl-benzoate

Systemtic Name: 3-phenylbutyl 5-azanyl-2-oxidanyl-benzoate Openeye Name: 3-phenylbutyl 5-amino-2-hydroxy-benzoate CAS Name: 5-amino-2-hydroxybenzoic acid 3-phenylbutyl ester IUPAC Name: 3-phenylbutyl 5-amino-2-hydroxybenzoate Traditional Name: 5-amino-2-hydroxy-benzoic acid 3-phenylbutyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1=C(C=CC(=C1)N)O)C2=CC=CC=C2

Isomeric SMILES

CC(CCOC(=O)C1=C(C=CC(=C1)N)O)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO3/c1-12(13-5-3-2-4-6-13)9-10-21-17(20)15-11-14(18)7-8-16(15)19/h2-8,11-12,19H,9-10,18H2,1H3