4-chloranyl-N-[(2S)-1-[[3-(cyclopropylcarbamoyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[[3-(cyclopropylcarbamoyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-1-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-[3-[(cyclopropylamino)-oxomethyl]anilino]-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-[3-(cyclopropylcarbamoyl)anilino]-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-1-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]-2-methyl-propyl]-3-nitro-benzamide Formula: C22H23ClN4O5 MolecularWeight: 458.89482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)NC2CC2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=CC(=C1)C(=O)NC2CC2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H23ClN4O5/c1-12(2)19(26-21(29)14-6-9-17(23)18(11-14)27(31)32)22(30)25-16-5-3-4-13(10-16)20(28)24-15-7-8-15/h3-6,9-12,15,19H,7-8H2,1-2H3,(H,24,28)(H,25,30)(H,26,29)/t19-/m0/s1