4-[(4-methoxycarbonyl-5-methyl-3-phenyl-pyrrol-2-ylidene)methylamino]benzoate

Systemtic Name: 4-[(4-methoxycarbonyl-5-methyl-3-phenyl-pyrrol-2-ylidene)methylamino]benzoate Openeye Name: 4-[(4-methoxycarbonyl-5-methyl-3-phenyl-pyrrol-2-ylidene)methylamino]benzoate CAS Name: 4-[(4-methoxycarbonyl-5-methyl-3-phenyl-2-pyrrolylidene)methylamino]benzoate IUPAC Name: 4-[(4-methoxycarbonyl-5-methyl-3-phenylpyrrol-2-ylidene)methylamino]benzoate Traditional Name: 4-[(4-carbomethoxy-5-methyl-3-phenyl-pyrrol-2-ylidene)methylamino]benzoate Formula: C21H17N2O4- MolecularWeight: 361.37068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CNC2=CC=C(C=C2)C(=O)[O-])C(=C1C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CNC2=CC=C(C=C2)C(=O)[O-])C(=C1C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O4/c1-13-18(21(26)27-2)19(14-6-4-3-5-7-14)17(23-13)12-22-16-10-8-15(9-11-16)20(24)25/h3-12,22H,1-2H3,(H,24,25)/p-1