N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethanoyl-3,4-dihydro-2H-quinoline-6-sulfonamide

Systemtic Name: N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1-ethanoyl-3,4-dihydro-2H-quinoline-6-sulfonamide Openeye Name: 1-acetyl-N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-3,4-dihydro-2H-quinoline-6-sulfonamide CAS Name: 1-acetyl-N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-3,4-dihydro-2H-quinoline-6-sulfonamide IUPAC Name: 1-acetyl-N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-3,4-dihydro-2H-quinoline-6-sulfonamide Traditional Name: 1-acetyl-N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-3,4-dihydro-2H-quinoline-6-sulfonamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NCC(C3=CC4=C(C=C3)OCO4)N(C)C

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NC[C@H](C3=CC4=C(C=C3)OCO4)N(C)C

InChI

InChI=1S/C22H27N3O5S/c1-15(26)25-10-4-5-16-11-18(7-8-19(16)25)31(27,28)23-13-20(24(2)3)17-6-9-21-22(12-17)30-14-29-21/h6-9,11-12,20,23H,4-5,10,13-14H2,1-3H3/t20-/m1/s1