(E)-3-(4-nitrophenyl)-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enamide Openeye Name: (E)-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(4-nitrophenyl)acrylamide Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O5S/c28-24(13-8-18-6-11-22(12-7-18)27(29)30)25-21-10-9-19-14-15-26(17-20(19)16-21)33(31,32)23-4-2-1-3-5-23/h1-13,16H,14-15,17H2,(H,25,28)/b13-8+