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

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(3-fluoranyl-4-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-1-[(3-fluoro-4-methyl-phenyl)carbamoyl]-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-(3-fluoro-4-methylanilino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-(3-fluoro-4-methylanilino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-1-[(3-fluoro-4-methyl-phenyl)carbamoyl]-2-methyl-propyl]-3-nitro-benzamide Formula: C19H19ClFN3O4 MolecularWeight: 407.823263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClFN3O4/c1-10(2)17(19(26)22-13-6-4-11(3)15(21)9-13)23-18(25)12-5-7-14(20)16(8-12)24(27)28/h4-10,17H,1-3H3,(H,22,26)(H,23,25)/t17-/m0/s1