N-[2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]carbamoyl]phenyl]-2-chloranyl-4-nitro-benzamide

Systemtic Name: N-[2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]carbamoyl]phenyl]-2-chloranyl-4-nitro-benzamide Openeye Name: N-[2-[[2-(tert-butylamino)-2-oxo-ethyl]carbamoyl]phenyl]-2-chloro-4-nitro-benzamide CAS Name: N-[2-[[[2-(tert-butylamino)-2-oxoethyl]amino]-oxomethyl]phenyl]-2-chloro-4-nitrobenzamide IUPAC Name: N-[2-[[2-(tert-butylamino)-2-oxoethyl]carbamoyl]phenyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[2-[[2-(tert-butylamino)-2-keto-ethyl]carbamoyl]phenyl]-2-chloro-4-nitro-benzamide Formula: C20H21ClN4O5 MolecularWeight: 432.85754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H21ClN4O5/c1-20(2,3)24-17(26)11-22-18(27)14-6-4-5-7-16(14)23-19(28)13-9-8-12(25(29)30)10-15(13)21/h4-10H,11H2,1-3H3,(H,22,27)(H,23,28)(H,24,26)