4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]benzaldehyde

Systemtic Name: 4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]benzaldehyde Openeye Name: 4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]benzothiophen-2-yl]benzaldehyde CAS Name: 4-[3-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]benzaldehyde IUPAC Name: 4-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]benzaldehyde Traditional Name: 4-[3-[4-(2-pyrrolidinoethoxy)benzyl]benzothiophen-2-yl]benzaldehyde Formula: C28H27NO2S MolecularWeight: 441.58448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)C=O

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)C=O

InChI

InChI=1S/C28H27NO2S/c30-20-22-7-11-23(12-8-22)28-26(25-5-1-2-6-27(25)32-28)19-21-9-13-24(14-10-21)31-18-17-29-15-3-4-16-29/h1-2,5-14,20H,3-4,15-19H2