N-[2,2-bis(phenylsulfonyl)ethenyl]isoquinolin-1-amine

Systemtic Name: N-[2,2-bis(phenylsulfonyl)ethenyl]isoquinolin-1-amine Openeye Name: N-[2,2-bis(benzenesulfonyl)vinyl]isoquinolin-1-amine CAS Name: N-[2,2-bis(benzenesulfonyl)ethenyl]-1-isoquinolinamine IUPAC Name: N-[2,2-bis(benzenesulfonyl)ethenyl]isoquinolin-1-amine Traditional Name: 2,2-dibesylvinyl(1-isoquinolyl)amine Formula: C23H18N2O4S2 MolecularWeight: 450.53002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=NC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O4S2/c26-30(27,19-10-3-1-4-11-19)22(31(28,29)20-12-5-2-6-13-20)17-25-23-21-14-8-7-9-18(21)15-16-24-23/h1-17H,(H,24,25)