2-[[2-(3-azanylpropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid

Systemtic Name: 2-[[2-(3-azanylpropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid Openeye Name: 6-[[2-(3-aminopropylamino)phenyl]sulfonylamino]tetralin-5-carboxylic acid CAS Name: 2-[[2-(3-aminopropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid IUPAC Name: 2-[[2-(3-aminopropylamino)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid Traditional Name: 6-[[2-(3-aminopropylamino)phenyl]sulfonylamino]tetralin-5-carboxylic acid Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2C(=O)O)NS(=O)(=O)C3=CC=CC=C3NCCCN

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2C(=O)O)NS(=O)(=O)C3=CC=CC=C3NCCCN

InChI

InChI=1S/C20H25N3O4S/c21-12-5-13-22-16-8-3-4-9-18(16)28(26,27)23-17-11-10-14-6-1-2-7-15(14)19(17)20(24)25/h3-4,8-11,22-23H,1-2,5-7,12-13,21H2,(H,24,25)