N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-piperidinosulfonyl-benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H27N3O4S/c1-17(27)25-14-11-18-5-8-21(15-20(18)16-25)24-23(28)19-6-9-22(10-7-19)31(29,30)26-12-3-2-4-13-26/h5-10,15H,2-4,11-14,16H2,1H3,(H,24,28)