1-azanylbutane-2-sulfonic acid; 4-methylbenzaldehyde

Systemtic Name: 1-azanylbutane-2-sulfonic acid; 4-methylbenzaldehyde Openeye Name: 1-aminobutane-2-sulfonic acid; 4-methylbenzaldehyde CAS Name: 1-amino-2-butanesulfonic acid; 4-methylbenzaldehyde IUPAC Name: 1-aminobutane-2-sulfonic acid; 4-methylbenzaldehyde Traditional Name: 1-aminobutane-2-sulfonic acid; 4-methylbenzaldehyde Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)S(=O)(=O)O.CC1=CC=C(C=C1)C=O

Isomeric SMILES

CCC(CN)S(=O)(=O)O.CC1=CC=C(C=C1)C=O

InChI

InChI=1S/C8H8O.C4H11NO3S/c1-7-2-4-8(6-9)5-3-7;1-2-4(3-5)9(6,7)8/h2-6H,1H3;4H,2-3,5H2,1H3,(H,6,7,8)