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

Systemtic Name: ethyl 3-[4-phenyl-1-[[4-(thiophen-3-ylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate Openeye Name: ethyl 3-[4-phenyl-1-[[4-(3-thienylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate CAS Name: 3-[4-phenyl-1-[[4-(3-thiophenylmethoxy)phenyl]methyl]-3-pyrrolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-phenyl-1-[[4-(thiophen-3-ylmethoxy)phenyl]methyl]pyrrol-3-yl]propanoate Traditional Name: 3-[4-phenyl-1-[4-(3-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=CSC=C4

Isomeric SMILES

CCOC(=O)CCC1=CN(C=C1C2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CSC=C4

InChI

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