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

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(3-fluorophenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-1-[(3-fluorophenyl)carbamoyl]-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-(3-fluoroanilino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-(3-fluoroanilino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-1-[(3-fluorophenyl)carbamoyl]-2-methyl-propyl]-3-nitro-benzamide Formula: C18H17ClFN3O4 MolecularWeight: 393.796683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=CC=C1)F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=CC=C1)F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClFN3O4/c1-10(2)16(18(25)21-13-5-3-4-12(20)9-13)22-17(24)11-6-7-14(19)15(8-11)23(26)27/h3-10,16H,1-2H3,(H,21,25)(H,22,24)/t16-/m0/s1