3-[1-(pyridin-3-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid

Systemtic Name: 3-[1-(pyridin-3-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid Openeye Name: 3-[1-(3-pyridylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid CAS Name: 3-[1-(3-pyridinylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid IUPAC Name: 3-[1-(pyridin-3-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid Traditional Name: 3-[1-(3-pyridylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propionic acid Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C3=CC=CC=C3N2CCC(=O)O)NS(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CC(C2=C(C1)C3=CC=CC=C3N2CCC(=O)O)NS(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H21N3O4S/c24-19(25)10-12-23-18-9-2-1-6-15(18)16-7-3-8-17(20(16)23)22-28(26,27)14-5-4-11-21-13-14/h1-2,4-6,9,11,13,17,22H,3,7-8,10,12H2,(H,24,25)