methyl 2-[2-chloranyl-4-[4-(5-thiophen-2-yl-3,4-dihydro-2H-pyrrol-2-yl)phenyl]phenoxy]pentanoate

Systemtic Name: methyl 2-[2-chloranyl-4-[4-(5-thiophen-2-yl-3,4-dihydro-2H-pyrrol-2-yl)phenyl]phenoxy]pentanoate Openeye Name: methyl 2-[2-chloro-4-[4-[5-(2-thienyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]phenoxy]pentanoate CAS Name: 2-[2-chloro-4-[4-(5-thiophen-2-yl-3,4-dihydro-2H-pyrrol-2-yl)phenyl]phenoxy]pentanoic acid methyl ester IUPAC Name: methyl 2-[2-chloro-4-[4-(5-thiophen-2-yl-3,4-dihydro-2H-pyrrol-2-yl)phenyl]phenoxy]pentanoate Traditional Name: 2-[2-chloro-4-[4-[5-(2-thienyl)-1-pyrrolin-2-yl]phenyl]phenoxy]valeric acid methyl ester Formula: C26H26ClNO3S MolecularWeight: 468.00754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C3CCC(=N3)C4=CC=CS4)Cl

Isomeric SMILES

CCCC(C(=O)OC)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C3CCC(=N3)C4=CC=CS4)Cl

InChI

InChI=1S/C26H26ClNO3S/c1-3-5-24(26(29)30-2)31-23-14-11-19(16-20(23)27)17-7-9-18(10-8-17)21-12-13-22(28-21)25-6-4-15-32-25/h4,6-11,14-16,21,24H,3,5,12-13H2,1-2H3