benzoic acid; 1-(sulfinoamino)butane

Systemtic Name: benzoic acid; 1-(sulfinoamino)butane Openeye Name: benzoic acid; 1-(sulfinoamino)butane CAS Name: benzoic acid; 1-(sulfinoamino)butane IUPAC Name: benzoic acid; 1-(sulfinoamino)butane Traditional Name: benzoic acid; 1-(sulfinoamino)butane Formula: C11H17NO4S MolecularWeight: 259.32198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)O.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCNS(=O)O.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C7H6O2.C4H11NO2S/c8-7(9)6-4-2-1-3-5-6;1-2-3-4-5-8(6)7/h1-5H,(H,8,9);5H,2-4H2,1H3,(H,6,7)