3-[6-(naphthalen-2-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid

Systemtic Name: 3-[6-(naphthalen-2-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid Openeye Name: 3-[6-(2-naphthylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid CAS Name: 3-[6-(2-naphthalenylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid IUPAC Name: 3-[6-(naphthalen-2-ylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid Traditional Name: 3-[6-(2-naphthylsulfonylamino)-1,2,3,4-tetrahydrocarbazol-9-yl]propionic acid Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N2CCC(=O)O)C=CC(=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC2=C(C1)C3=C(N2CCC(=O)O)C=CC(=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H24N2O4S/c28-25(29)13-14-27-23-8-4-3-7-21(23)22-16-19(10-12-24(22)27)26-32(30,31)20-11-9-17-5-1-2-6-18(17)15-20/h1-2,5-6,9-12,15-16,26H,3-4,7-8,13-14H2,(H,28,29)