N-[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]methylideneamino]-2-(2-nitrophenyl)ethanamide

Systemtic Name: N-[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]methylideneamino]-2-(2-nitrophenyl)ethanamide Openeye Name: N-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-2-(2-nitrophenyl)acetamide CAS Name: N-[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]methylideneamino]-2-(2-nitrophenyl)acetamide IUPAC Name: N-[(1-benzyl-2,5-dimethylpyrrol-3-yl)methylideneamino]-2-(2-nitrophenyl)acetamide Traditional Name: N-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-2-(2-nitrophenyl)acetamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C=NNC(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C=NNC(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O3/c1-16-12-20(17(2)25(16)15-18-8-4-3-5-9-18)14-23-24-22(27)13-19-10-6-7-11-21(19)26(28)29/h3-12,14H,13,15H2,1-2H3,(H,24,27)