ethyl 4-[5-(phenylsulfonylamino)-3,4-dihydro-1H-isoquinolin-2-yl]butanoate

Systemtic Name: ethyl 4-[5-(phenylsulfonylamino)-3,4-dihydro-1H-isoquinolin-2-yl]butanoate Openeye Name: ethyl 4-[5-(benzenesulfonamido)-3,4-dihydro-1H-isoquinolin-2-yl]butanoate CAS Name: 4-[5-(benzenesulfonamido)-3,4-dihydro-1H-isoquinolin-2-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[5-(benzenesulfonamido)-3,4-dihydro-1H-isoquinolin-2-yl]butanoate Traditional Name: 4-[5-(benzenesulfonamido)-3,4-dihydro-1H-isoquinolin-2-yl]butyric acid ethyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1CCC2=C(C1)C=CC=C2NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCN1CCC2=C(C1)C=CC=C2NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-2-27-21(24)12-7-14-23-15-13-19-17(16-23)8-6-11-20(19)22-28(25,26)18-9-4-3-5-10-18/h3-6,8-11,22H,2,7,12-16H2,1H3