ethyl 3-[4-phenyl-1-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate

Systemtic Name: ethyl 3-[4-phenyl-1-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate Openeye Name: ethyl 3-[4-phenyl-1-[[4-(2-thienylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate CAS Name: 3-[4-phenyl-1-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]-3-pyrrolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-phenyl-1-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate Traditional Name: 3-[4-phenyl-1-[4-(2-thenyloxy)benzyl]pyrrol-3-yl]propionic acid ethyl ester Formula: C27H27NO3S MolecularWeight: 445.57318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CN(C=C1C2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CS4

Isomeric SMILES

CCOC(=O)CCC1=CN(C=C1C2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CS4

InChI

InChI=1S/C27H27NO3S/c1-2-30-27(29)15-12-23-18-28(19-26(23)22-7-4-3-5-8-22)17-21-10-13-24(14-11-21)31-20-25-9-6-16-32-25/h3-11,13-14,16,18-19H,2,12,15,17,20H2,1H3