methyl 5-[[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carbonyl)amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[4-cyano-2-methyl-5-(1-pyrrolyl)-3-furanyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[(4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carbonyl)amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[(4-cyano-2-methyl-5-pyrrol-1-yl-3-furoyl)amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NCC3=CC(=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NCC3=CC(=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C21H19N3O5/c1-13-18(16(11-22)20(29-13)24-8-4-5-9-24)19(25)23-12-14-6-7-17(27-2)15(10-14)21(26)28-3/h4-10H,12H2,1-3H3,(H,23,25)