(2-cyclododecyl-6-methoxy-1-benzothiophen-3-yl)-[4-(2-piperidin-1-ylethoxy)phenyl]methanone

Systemtic Name: (2-cyclododecyl-6-methoxy-1-benzothiophen-3-yl)-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Openeye Name: (2-cyclododecyl-6-methoxy-benzothiophen-3-yl)-[4-[2-(1-piperidyl)ethoxy]phenyl]methanone CAS Name: (2-cyclododecyl-6-methoxy-1-benzothiophen-3-yl)-[4-[2-(1-piperidinyl)ethoxy]phenyl]methanone IUPAC Name: (2-cyclododecyl-6-methoxy-1-benzothiophen-3-yl)-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Traditional Name: (2-cyclododecyl-6-methoxy-benzothiophen-3-yl)-[4-(2-piperidinoethoxy)phenyl]methanone Formula: C35H47NO3S MolecularWeight: 561.81758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3CCCCCCCCCCC3)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3CCCCCCCCCCC3)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C35H47NO3S/c1-38-30-20-21-31-32(26-30)40-35(28-14-10-7-5-3-2-4-6-8-11-15-28)33(31)34(37)27-16-18-29(19-17-27)39-25-24-36-22-12-9-13-23-36/h16-21,26,28H,2-15,22-25H2,1H3