1-[[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethylamino]methylidene]naphthalen-2-one

Systemtic Name: 1-[[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethylamino]methylidene]naphthalen-2-one Openeye Name: 1-[[2-(4-methylsulfonyl-2-nitro-anilino)ethylamino]methylene]naphthalen-2-one CAS Name: 1-[[2-(4-methylsulfonyl-2-nitroanilino)ethylamino]methylidene]-2-naphthalenone IUPAC Name: 1-[[2-(4-methylsulfonyl-2-nitroanilino)ethylamino]methylidene]naphthalen-2-one Traditional Name: 1-[[2-(4-mesyl-2-nitro-anilino)ethylamino]methylene]naphthalen-2-one Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC=C2C(=O)C=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC=C2C(=O)C=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5S/c1-29(27,28)15-7-8-18(19(12-15)23(25)26)22-11-10-21-13-17-16-5-3-2-4-14(16)6-9-20(17)24/h2-9,12-13,21-22H,10-11H2,1H3