2-[(7-carbamimidoylnaphthalen-2-yl)methyl]-1-sulfamoyl-cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(7-carbamimidoylnaphthalen-2-yl)methyl]-1-sulfamoyl-cyclohexane-1-carboxylic acid Openeye Name: 2-[(7-carbamimidoyl-2-naphthyl)methyl]-1-sulfamoyl-cyclohexanecarboxylic acid CAS Name: 2-[(7-carbamimidoyl-2-naphthalenyl)methyl]-1-sulfamoyl-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(7-carbamimidoylnaphthalen-2-yl)methyl]-1-sulfamoylcyclohexane-1-carboxylic acid Traditional Name: 2-[(7-amidino-2-naphthyl)methyl]-1-sulfamoyl-cyclohexanecarboxylic acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC2=CC3=C(C=C2)C=CC(=C3)C(=N)N)(C(=O)O)S(=O)(=O)N

Isomeric SMILES

C1CCC(C(C1)CC2=CC3=C(C=C2)C=CC(=C3)C(=N)N)(C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C19H23N3O4S/c20-17(21)14-7-6-13-5-4-12(9-15(13)11-14)10-16-3-1-2-8-19(16,18(23)24)27(22,25)26/h4-7,9,11,16H,1-3,8,10H2,(H3,20,21)(H,23,24)(H2,22,25,26)