2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C20H23BrN4O5 MolecularWeight: 479.32442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23BrN4O5/c1-12-9-14(21)5-7-16(12)22-19(26)11-24(3)13(2)20(27)23-17-10-15(25(28)29)6-8-18(17)30-4/h5-10,13H,11H2,1-4H3,(H,22,26)(H,23,27)