[1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(3,4-dimethoxyphenyl)methanone

Systemtic Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(3,4-dimethoxyphenyl)methanone Openeye Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(3,4-dimethoxyphenyl)methanone CAS Name: [1,2-bis(propylsulfonyl)-3-pyrrolo[2,1-a]isoquinolinyl]-(3,4-dimethoxyphenyl)methanone IUPAC Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(3,4-dimethoxyphenyl)methanone Traditional Name: [1,2-bis(propylsulfonyl)pyrrol[2,1-a]isoquinolin-3-yl]-(3,4-dimethoxyphenyl)methanone Formula: C27H29NO7S2 MolecularWeight: 543.65166

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H29NO7S2/c1-5-15-36(30,31)26-23-20-10-8-7-9-18(20)13-14-28(23)24(27(26)37(32,33)16-6-2)25(29)19-11-12-21(34-3)22(17-19)35-4/h7-14,17H,5-6,15-16H2,1-4H3