4-tert-butyl-N-[3-[(2-methoxy-5-nitro-phenyl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(2-methoxy-5-nitro-phenyl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(2-methoxy-5-nitro-anilino)-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-(2-methoxy-5-nitroanilino)-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(2-methoxy-5-nitroanilino)-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-keto-3-(2-methoxy-5-nitro-anilino)propyl]benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C21H25N3O5/c1-21(2,3)15-7-5-14(6-8-15)20(26)22-12-11-19(25)23-17-13-16(24(27)28)9-10-18(17)29-4/h5-10,13H,11-12H2,1-4H3,(H,22,26)(H,23,25)