N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-4-ethoxy-benzenesulfonamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-4-ethoxy-benzenesulfonamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-4-ethoxybenzenesulfonamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-4-ethoxy-benzenesulfonamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H24N2O4S/c1-2-26-18-7-9-19(10-8-18)27(24,25)21-13-11-20(23)22-14-12-16-5-3-4-6-17(16)15-22/h3-10,21H,2,11-15H2,1H3