sodium 1H-inden-5-yl 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: sodium 1H-inden-5-yl 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: sodium 1H-inden-5-yl 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: sodium 3-[(4-chlorophenyl)sulfonylamino]propanoic acid 1H-inden-5-yl ester IUPAC Name: sodium 1H-inden-5-yl 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: sodium 3-[(4-chlorophenyl)sulfonylamino]propionic acid 1H-inden-5-yl ester Formula: C18H16ClNNaO4S+ MolecularWeight: 400.83171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2=C1C=CC(=C2)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl.[Na+]

Isomeric SMILES

C1C=CC2=C1C=CC(=C2)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl.[Na+]

InChI

InChI=1S/C18H16ClNO4S.Na/c19-15-5-8-17(9-6-15)25(22,23)20-11-10-18(21)24-16-7-4-13-2-1-3-14(13)12-16;/h1,3-9,12,20H,2,10-11H2;/q;+1