3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenyl-benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenyl-benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenyl-benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenylbenzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenylbenzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-methoxy-N-phenyl-benzamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H22N2O4S/c1-29-21-12-11-18(23(26)24-20-9-3-2-4-10-20)15-22(21)30(27,28)25-14-13-17-7-5-6-8-19(17)16-25/h2-12,15H,13-14,16H2,1H3,(H,24,26)