N-[(E)-[4-(tert-butylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-chloranyl-4-nitro-benzamide

Systemtic Name: N-[(E)-[4-(tert-butylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-chloranyl-4-nitro-benzamide Openeye Name: N-[(E)-[3-(tert-butylamino)-1-methyl-3-oxo-propylidene]amino]-3-chloro-4-nitro-benzamide CAS Name: N-[(E)-[4-(tert-butylamino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide IUPAC Name: N-[(E)-[4-(tert-butylamino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide Traditional Name: N-[(E)-[3-(tert-butylamino)-3-keto-1-methyl-propylidene]amino]-3-chloro-4-nitro-benzamide Formula: C15H19ClN4O4 MolecularWeight: 354.78876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])Cl)CC(=O)NC(C)(C)C

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])Cl)/CC(=O)NC(C)(C)C

InChI

InChI=1S/C15H19ClN4O4/c1-9(7-13(21)17-15(2,3)4)18-19-14(22)10-5-6-12(20(23)24)11(16)8-10/h5-6,8H,7H2,1-4H3,(H,17,21)(H,19,22)/b18-9+