2,3-dihydro-1H-inden-5-yl 5-(acetamidomethyl)thiophene-2-sulfonate

Systemtic Name: 2,3-dihydro-1H-inden-5-yl 5-(acetamidomethyl)thiophene-2-sulfonate Openeye Name: indan-5-yl 5-(acetamidomethyl)thiophene-2-sulfonate CAS Name: 5-(acetamidomethyl)-2-thiophenesulfonic acid 2,3-dihydro-1H-inden-5-yl ester IUPAC Name: 2,3-dihydro-1H-inden-5-yl 5-(acetamidomethyl)thiophene-2-sulfonate Traditional Name: 5-(acetamidomethyl)thiophene-2-sulfonic acid indan-5-yl ester Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)S(=O)(=O)OC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)S(=O)(=O)OC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C16H17NO4S2/c1-11(18)17-10-15-7-8-16(22-15)23(19,20)21-14-6-5-12-3-2-4-13(12)9-14/h5-9H,2-4,10H2,1H3,(H,17,18)