N-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-benzofuran-7-yl]-2,6-bis(chloranyl)-3-nitro-benzamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-benzofuran-7-yl]-2,6-bis(chloranyl)-3-nitro-benzamide Openeye Name: N-[3-(2-amino-2-oxo-ethyl)-2-methyl-benzofuran-7-yl]-2,6-dichloro-3-nitro-benzamide CAS Name: N-[3-(2-amino-2-oxoethyl)-2-methyl-7-benzofuranyl]-2,6-dichloro-3-nitrobenzamide IUPAC Name: N-[3-(2-amino-2-oxoethyl)-2-methyl-1-benzofuran-7-yl]-2,6-dichloro-3-nitrobenzamide Traditional Name: N-[3-(2-amino-2-keto-ethyl)-2-methyl-benzofuran-7-yl]-2,6-dichloro-3-nitro-benzamide Formula: C18H13Cl2N3O5 MolecularWeight: 422.21892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C(=CC=C2)NC(=O)C3=C(C=CC(=C3Cl)[N+](=O)[O-])Cl)CC(=O)N

Isomeric SMILES

CC1=C(C2=C(O1)C(=CC=C2)NC(=O)C3=C(C=CC(=C3Cl)[N+](=O)[O-])Cl)CC(=O)N

InChI

InChI=1S/C18H13Cl2N3O5/c1-8-10(7-14(21)24)9-3-2-4-12(17(9)28-8)22-18(25)15-11(19)5-6-13(16(15)20)23(26)27/h2-6H,7H2,1H3,(H2,21,24)(H,22,25)