3-[methylsulfonyl(propyl)amino]-5-prop-2-enyl-benzoic acid

Systemtic Name: 3-[methylsulfonyl(propyl)amino]-5-prop-2-enyl-benzoic acid Openeye Name: 3-allyl-5-[methylsulfonyl(propyl)amino]benzoic acid CAS Name: 3-[methylsulfonyl(propyl)amino]-5-prop-2-enylbenzoic acid IUPAC Name: 3-[methylsulfonyl(propyl)amino]-5-prop-2-enylbenzoic acid Traditional Name: 3-allyl-5-[mesyl(propyl)amino]benzoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC(=CC(=C1)CC=C)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CCCN(C1=CC(=CC(=C1)CC=C)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C14H19NO4S/c1-4-6-11-8-12(14(16)17)10-13(9-11)15(7-5-2)20(3,18)19/h4,8-10H,1,5-7H2,2-3H3,(H,16,17)