2-chloranyl-N-[1-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[1-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[1-[3-(3,5-dimethylpyrazol-1-yl)propylcarbamoyl]-2-methyl-propyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[1-[3-(3,5-dimethyl-1-pyrazolyl)propylamino]-3-methyl-1-oxobutan-2-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[1-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-3-methyl-1-oxobutan-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[1-[3-(3,5-dimethylpyrazol-1-yl)propylcarbamoyl]-2-methyl-propyl]-4-nitro-benzamide Formula: C20H26ClN5O4 MolecularWeight: 435.90454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C(C(C)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C(C(C)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C20H26ClN5O4/c1-12(2)18(20(28)22-8-5-9-25-14(4)10-13(3)24-25)23-19(27)16-7-6-15(26(29)30)11-17(16)21/h6-7,10-12,18H,5,8-9H2,1-4H3,(H,22,28)(H,23,27)