methyl 4-[5-(3-chloranyl-4,7-dimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[5-(3-chloranyl-4,7-dimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[5-(3-chloro-4,7-dimethyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoate CAS Name: 4-[5-(3-chloro-4,7-dimethyl-2-benzofuranyl)-1H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(3-chloro-4,7-dimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoate Traditional Name: 4-[5-(3-chloro-4,7-dimethyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid methyl ester Formula: C22H18ClNO3 MolecularWeight: 379.83622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)OC(=C2Cl)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)C)OC(=C2Cl)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H18ClNO3/c1-12-4-5-13(2)20-18(12)19(23)21(27-20)17-11-10-16(24-17)14-6-8-15(9-7-14)22(25)26-3/h4-11,24H,1-3H3