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

Systemtic Name: 4-chloranyl-N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-1-(2-furylmethylcarbamoyl)-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-(2-furanylmethylamino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-1-(2-furfurylcarbamoyl)-2-methyl-propyl]-3-nitro-benzamide Formula: C17H18ClN3O5 MolecularWeight: 379.79492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=CO1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=CO1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O5/c1-10(2)15(17(23)19-9-12-4-3-7-26-12)20-16(22)11-5-6-13(18)14(8-11)21(24)25/h3-8,10,15H,9H2,1-2H3,(H,19,23)(H,20,22)/t15-/m0/s1