N-[2-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-[[(4-chlorophenyl)-(1-methyl-2-imidazolyl)methyl]amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C21H20ClN5O4 MolecularWeight: 441.8676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC(C2=CC=C(C=C2)Cl)C3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC(C2=CC=C(C=C2)Cl)C3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN5O4/c1-13-3-4-15(11-17(13)27(30)31)21(29)24-12-18(28)25-19(20-23-9-10-26(20)2)14-5-7-16(22)8-6-14/h3-11,19H,12H2,1-2H3,(H,24,29)(H,25,28)