1-[2-[4-[2-(4-chlorophenyl)-1-benzothiophen-6-yl]-2-methoxy-phenoxy]ethyl]pyrrolidine

Systemtic Name: 1-[2-[4-[2-(4-chlorophenyl)-1-benzothiophen-6-yl]-2-methoxy-phenoxy]ethyl]pyrrolidine Openeye Name: 1-[2-[4-[2-(4-chlorophenyl)benzothiophen-6-yl]-2-methoxy-phenoxy]ethyl]pyrrolidine CAS Name: 1-[2-[4-[2-(4-chlorophenyl)-1-benzothiophen-6-yl]-2-methoxyphenoxy]ethyl]pyrrolidine IUPAC Name: 1-[2-[4-[2-(4-chlorophenyl)-1-benzothiophen-6-yl]-2-methoxyphenoxy]ethyl]pyrrolidine Traditional Name: 1-[2-[4-[2-(4-chlorophenyl)benzothiophen-6-yl]-2-methoxy-phenoxy]ethyl]pyrrolidine Formula: C27H26ClNO2S MolecularWeight: 464.01884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C=C(S3)C4=CC=C(C=C4)Cl)OCCN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=C(C=C2)C=C(S3)C4=CC=C(C=C4)Cl)OCCN5CCCC5

InChI

InChI=1S/C27H26ClNO2S/c1-30-25-16-20(8-11-24(25)31-15-14-29-12-2-3-13-29)21-4-5-22-18-26(32-27(22)17-21)19-6-9-23(28)10-7-19/h4-11,16-18H,2-3,12-15H2,1H3