methyl 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: methyl 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 4-[3-(1,3-benzodioxol-5-yliminomethyl)-2,5-dimethyl-pyrrol-1-yl]benzoic acid methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H20N2O4/c1-14-10-17(12-23-18-6-9-20-21(11-18)28-13-27-20)15(2)24(14)19-7-4-16(5-8-19)22(25)26-3/h4-12H,13H2,1-3H3