N-cyclohexylcyclohexanamine; 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid

Systemtic Name: N-cyclohexylcyclohexanamine; 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid Openeye Name: N-cyclohexylcyclohexanamine; 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]butanedioic acid CAS Name: N-cyclohexylcyclohexanamine; 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]butanedioic acid IUPAC Name: N-cyclohexylcyclohexanamine; 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanedioic acid Traditional Name: dicyclohexylamine; 2-(naphthionylamino)succinic acid Formula: C28H41N3O6S MolecularWeight: 547.70664

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC(=O)O)C(=O)O.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC(=O)O)C(=O)O.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C16H18N2O6S.C12H23N/c1-18(2)13-7-3-6-11-10(13)5-4-8-14(11)25(23,24)17-12(16(21)22)9-15(19)20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h3-8,12,17H,9H2,1-2H3,(H,19,20)(H,21,22);11-13H,1-10H2