ethyl 4-(3-azanyl-2-oxidanyl-propoxy)-3-ethoxy-benzoate

Systemtic Name: ethyl 4-(3-azanyl-2-oxidanyl-propoxy)-3-ethoxy-benzoate Openeye Name: ethyl 4-(3-amino-2-hydroxy-propoxy)-3-ethoxy-benzoate CAS Name: 4-(3-amino-2-hydroxypropoxy)-3-ethoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-(3-amino-2-hydroxypropoxy)-3-ethoxybenzoate Traditional Name: 4-(3-amino-2-hydroxy-propoxy)-3-ethoxy-benzoic acid ethyl ester Formula: C14H21NO5 MolecularWeight: 283.32024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC)OCC(CN)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC)OCC(CN)O

InChI

InChI=1S/C14H21NO5/c1-3-18-13-7-10(14(17)19-4-2)5-6-12(13)20-9-11(16)8-15/h5-7,11,16H,3-4,8-9,15H2,1-2H3