4-azanyl-4-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-butanoate; cyclohexylazanium

Systemtic Name: 4-azanyl-4-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-butanoate; cyclohexylazanium Openeye Name: 4-amino-4-[[5-(dimethylamino)-1-naphthyl]sulfonyl]butanoate; cyclohexylammonium CAS Name: 4-amino-4-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]butanoate; cyclohexylammonium IUPAC Name: 4-amino-4-[5-(dimethylamino)naphthalen-1-yl]sulfonylbutanoate; cyclohexylazanium Traditional Name: 4-amino-4-naphthionyl-butyrate; cyclohexylammonium Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C(CCC(=O)[O-])N.C1CCC(CC1)[NH3+]

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C(CCC(=O)[O-])N.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C16H20N2O4S.C6H13N/c1-18(2)13-7-3-6-12-11(13)5-4-8-14(12)23(21,22)15(17)9-10-16(19)20;7-6-4-2-1-3-5-6/h3-8,15H,9-10,17H2,1-2H3,(H,19,20);6H,1-5,7H2