4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[2-(2-phenylethanoyl)hydrazinyl]butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[2-(2-phenylethanoyl)hydrazinyl]butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-methyl-1-[[(2-phenylacetyl)amino]carbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-methyl-1-oxo-1-[(1-oxo-2-phenylethyl)hydrazo]butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-methyl-1-oxo-1-[2-(2-phenylacetyl)hydrazinyl]butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-methyl-1-[[(2-phenylacetyl)amino]carbamoyl]propyl]-3-nitro-benzamide Formula: C20H21ClN4O5 MolecularWeight: 432.85754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NNC(=O)CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O5/c1-12(2)18(20(28)24-23-17(26)10-13-6-4-3-5-7-13)22-19(27)14-8-9-15(21)16(11-14)25(29)30/h3-9,11-12,18H,10H2,1-2H3,(H,22,27)(H,23,26)(H,24,28)