2-azanyl-N-[(E)-[1-(2-methoxy-4-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide

Systemtic Name: 2-azanyl-N-[(E)-[1-(2-methoxy-4-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide Openeye Name: 2-amino-N-[(E)-[1-(2-methoxy-4-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide CAS Name: 2-amino-N-[(E)-[1-(2-methoxy-4-nitrophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzamide IUPAC Name: 2-amino-N-[(E)-[1-(2-methoxy-4-nitrophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzamide Traditional Name: 2-amino-N-[(E)-[1-(2-methoxy-4-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])OC)C)C=NNC(=O)C3=CC=CC=C3N

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])OC)C)/C=N/NC(=O)C3=CC=CC=C3N

InChI

InChI=1S/C21H21N5O4/c1-13-10-15(12-23-24-21(27)17-6-4-5-7-18(17)22)14(2)25(13)19-9-8-16(26(28)29)11-20(19)30-3/h4-12H,22H2,1-3H3,(H,24,27)/b23-12+