methyl 4-[3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]benzoate

Systemtic Name: methyl 4-[3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]benzoate Openeye Name: methyl 4-[3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-2-yl]benzoate CAS Name: 4-[3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]benzoate Traditional Name: 4-[3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-2-yl]benzoic acid methyl ester Formula: C30H29NO4S MolecularWeight: 499.62056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C30H29NO4S/c1-34-30(33)23-11-9-22(10-12-23)29-27(25-7-3-4-8-26(25)36-29)28(32)21-13-15-24(16-14-21)35-20-19-31-17-5-2-6-18-31/h3-4,7-16H,2,5-6,17-20H2,1H3