4-chloranyl-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]butanamide

Systemtic Name: 4-chloranyl-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]butanamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-chloro-butanamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-chlorobutanamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-chlorobutanamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-chloro-butyramide Formula: C19H21ClN2O3S MolecularWeight: 392.89964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)CCCCl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)CCCCl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21ClN2O3S/c20-11-4-7-19(23)21-17-9-8-15-10-12-22(14-16(15)13-17)26(24,25)18-5-2-1-3-6-18/h1-3,5-6,8-9,13H,4,7,10-12,14H2,(H,21,23)