N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]tetralin-6-carboxamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]tetralin-6-carboxamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-29(27,28)17-8-9-18(19(13-17)23(25)26)21-10-11-22-20(24)16-7-6-14-4-2-3-5-15(14)12-16/h6-9,12-13,21H,2-5,10-11H2,1H3,(H,22,24)