2-azanyl-3-[1-[5-(dimethylamino)naphthalen-1-yl]sulfonylindol-3-yl]propanoic acid; cyclohexanamine

Systemtic Name: 2-azanyl-3-[1-[5-(dimethylamino)naphthalen-1-yl]sulfonylindol-3-yl]propanoic acid; cyclohexanamine Openeye Name: 2-amino-3-[1-[[5-(dimethylamino)-1-naphthyl]sulfonyl]indol-3-yl]propanoic acid; cyclohexanamine CAS Name: 2-amino-3-[1-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]-3-indolyl]propanoic acid; cyclohexanamine IUPAC Name: 2-amino-3-[1-[5-(dimethylamino)naphthalen-1-yl]sulfonylindol-3-yl]propanoic acid; cyclohexanamine Traditional Name: 2-amino-3-(1-naphthionylindol-3-yl)propionic acid; cyclohexylamine Formula: C29H36N4O4S MolecularWeight: 536.68554

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N3C=C(C4=CC=CC=C43)CC(C(=O)O)N.C1CCC(CC1)N

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N3C=C(C4=CC=CC=C43)CC(C(=O)O)N.C1CCC(CC1)N

InChI

InChI=1S/C23H23N3O4S.C6H13N/c1-25(2)20-11-5-9-18-17(20)8-6-12-22(18)31(29,30)26-14-15(13-19(24)23(27)28)16-7-3-4-10-21(16)26;7-6-4-2-1-3-5-6/h3-12,14,19H,13,24H2,1-2H3,(H,27,28);6H,1-5,7H2