N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]quinoline-2-carboxamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]quinoline-2-carboxamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]quinoline-2-carboxamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-quinolinecarboxamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]quinoline-2-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]quinaldamide Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=NC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5S/c1-29(27,28)14-7-9-16(18(12-14)23(25)26)20-10-11-21-19(24)17-8-6-13-4-2-3-5-15(13)22-17/h2-9,12,20H,10-11H2,1H3,(H,21,24)