N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxy-benzamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxy-benzamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxy-benzamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxybenzamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxybenzamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3-phenoxy-benzamide Formula: C28H24N2O4S MolecularWeight: 484.56616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O4S/c31-28(22-9-6-12-26(19-22)34-25-10-2-1-3-11-25)29-24-13-15-27(16-14-24)35(32,33)30-18-17-21-7-4-5-8-23(21)20-30/h1-16,19H,17-18,20H2,(H,29,31)