1-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4-isoquinolin-5-ylsulfonyl-2,3-dihydroquinoxaline

Systemtic Name: 1-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4-isoquinolin-5-ylsulfonyl-2,3-dihydroquinoxaline Openeye Name: 1-[(E)-3-(4-chlorophenyl)allyl]-4-(5-isoquinolylsulfonyl)-2,3-dihydroquinoxaline CAS Name: 1-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4-(5-isoquinolinylsulfonyl)-2,3-dihydroquinoxaline IUPAC Name: 1-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4-isoquinolin-5-ylsulfonyl-2,3-dihydroquinoxaline Traditional Name: 1-[(E)-3-(4-chlorophenyl)allyl]-4-(5-isoquinolylsulfonyl)-2,3-dihydroquinoxaline Formula: C26H22ClN3O2S MolecularWeight: 475.98978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2N1CC=CC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CN(C2=CC=CC=C2N1C/C=C/C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C26H22ClN3O2S/c27-22-12-10-20(11-13-22)5-4-16-29-17-18-30(25-8-2-1-7-24(25)29)33(31,32)26-9-3-6-21-19-28-15-14-23(21)26/h1-15,19H,16-18H2/b5-4+