3-phenylpropyl 5-azanyl-2-oxidanyl-benzoate

Systemtic Name: 3-phenylpropyl 5-azanyl-2-oxidanyl-benzoate Openeye Name: 3-phenylpropyl 5-amino-2-hydroxy-benzoate CAS Name: 5-amino-2-hydroxybenzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-amino-2-hydroxybenzoate Traditional Name: 5-amino-2-hydroxy-benzoic acid 3-phenylpropyl ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3/c17-13-8-9-15(18)14(11-13)16(19)20-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,18H,4,7,10,17H2