2-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid

Systemtic Name: 2-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid Openeye Name: 2-[4-[allyl(methyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid CAS Name: 2-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid IUPAC Name: 2-[4-[methyl(prop-2-enyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid Traditional Name: 2-[4-[allyl(methyl)amino]butoxy]-3,4-dihydro-2H-quinoline-1-sulfonic acid Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCOC1CCC2=CC=CC=C2N1S(=O)(=O)O)CC=C

Isomeric SMILES

CN(CCCCOC1CCC2=CC=CC=C2N1S(=O)(=O)O)CC=C

InChI

InChI=1S/C17H26N2O4S/c1-3-12-18(2)13-6-7-14-23-17-11-10-15-8-4-5-9-16(15)19(17)24(20,21)22/h3-5,8-9,17H,1,6-7,10-14H2,2H3,(H,20,21,22)