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

Systemtic Name: N-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl]-4-ethoxy-3-methyl-benzenesulfonamide Openeye Name: N-[(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl]-4-ethoxy-3-methyl-benzenesulfonamide CAS Name: N-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-ethoxy-3-methylbenzenesulfonamide IUPAC Name: N-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-ethoxy-3-methylbenzenesulfonamide Traditional Name: N-[(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl]-4-ethoxy-3-methyl-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N[C@H](C)C(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C21H26N2O4S/c1-4-27-20-10-9-19(13-15(20)2)28(25,26)22-16(3)21(24)23-12-11-17-7-5-6-8-18(17)14-23/h5-10,13,16,22H,4,11-12,14H2,1-3H3/t16-/m1/s1