N-(2-dimethylaminoethyl)-3-[1-[(4-methoxyphenyl)amino]-2-methyl-1-oxidanylidene-propan-2-yl]-4-nitro-benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-[1-[(4-methoxyphenyl)amino]-2-methyl-1-oxidanylidene-propan-2-yl]-4-nitro-benzamide Openeye Name: N-(2-dimethylaminoethyl)-3-[2-(4-methoxyanilino)-1,1-dimethyl-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-(2-dimethylaminoethyl)-3-[1-(4-methoxyanilino)-2-methyl-1-oxopropan-2-yl]-4-nitrobenzamide IUPAC Name: N-(2-dimethylaminoethyl)-3-[1-(4-methoxyanilino)-2-methyl-1-oxopropan-2-yl]-4-nitrobenzamide Traditional Name: N-(2-dimethylaminoethyl)-3-[2-keto-1,1-dimethyl-2-(p-anisidino)ethyl]-4-nitro-benzamide Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C=CC(=C1)C(=O)NCCN(C)C)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C1=C(C=CC(=C1)C(=O)NCCN(C)C)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H28N4O5/c1-22(2,21(28)24-16-7-9-17(31-5)10-8-16)18-14-15(6-11-19(18)26(29)30)20(27)23-12-13-25(3)4/h6-11,14H,12-13H2,1-5H3,(H,23,27)(H,24,28)