3-(4-aminophenyl)propyl hydrogen sulfate

Systemtic Name: 3-(4-aminophenyl)propyl hydrogen sulfate Openeye Name: 3-(4-aminophenyl)propyl hydrogen sulfate CAS Name: sulfuric acid 3-(4-aminophenyl)propyl ester IUPAC Name: 3-(4-aminophenyl)propyl hydrogen sulfate Traditional Name: sulfuric acid 3-(4-aminophenyl)propyl ester Formula: C9H13NO4S MolecularWeight: 231.26882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCOS(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1CCCOS(=O)(=O)O)N

InChI

InChI=1S/C9H13NO4S/c10-9-5-3-8(4-6-9)2-1-7-14-15(11,12)13/h3-6H,1-2,7,10H2,(H,11,12,13)