ethyl 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2,5-dimethyl-3-[(3-nitrophenyl)iminomethyl]pyrrol-1-yl]benzoic acid ethyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=NC3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=NC3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H21N3O4/c1-4-29-22(26)17-8-10-20(11-9-17)24-15(2)12-18(16(24)3)14-23-19-6-5-7-21(13-19)25(27)28/h5-14H,4H2,1-3H3