N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3,4,5-trimethoxy-N-methyl-2-nitrobenzamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3,4,5-trimethoxy-N-methyl-2-nitrobenzamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide Formula: C20H22BrN3O7 MolecularWeight: 496.30858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C20H22BrN3O7/c1-11-8-12(21)6-7-14(11)22-16(25)10-23(2)20(26)13-9-15(29-3)18(30-4)19(31-5)17(13)24(27)28/h6-9H,10H2,1-5H3,(H,22,25)