4-(2,3-dihydro-1H-inden-1-ylamino)butane-2-sulfonic acid

Systemtic Name: 4-(2,3-dihydro-1H-inden-1-ylamino)butane-2-sulfonic acid Openeye Name: 4-(indan-1-ylamino)butane-2-sulfonic acid CAS Name: 4-(2,3-dihydro-1H-inden-1-ylamino)-2-butanesulfonic acid IUPAC Name: 4-(2,3-dihydro-1H-inden-1-ylamino)butane-2-sulfonic acid Traditional Name: 4-(indan-1-ylamino)butane-2-sulfonic acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC1CCC2=CC=CC=C12)S(=O)(=O)O

Isomeric SMILES

CC(CCNC1CCC2=CC=CC=C12)S(=O)(=O)O

InChI

InChI=1S/C13H19NO3S/c1-10(18(15,16)17)8-9-14-13-7-6-11-4-2-3-5-12(11)13/h2-5,10,13-14H,6-9H2,1H3,(H,15,16,17)