methyl 2-[1-[(1-naphthalen-1-ylcarbonyl-4-thiophen-3-yl-pyrrolidin-3-yl)methyl]piperidin-4-yl]benzoate

Systemtic Name: methyl 2-[1-[(1-naphthalen-1-ylcarbonyl-4-thiophen-3-yl-pyrrolidin-3-yl)methyl]piperidin-4-yl]benzoate Openeye Name: methyl 2-[1-[[1-(naphthalene-1-carbonyl)-4-(3-thienyl)pyrrolidin-3-yl]methyl]-4-piperidyl]benzoate CAS Name: 2-[1-[[1-[1-naphthalenyl(oxo)methyl]-4-(3-thiophenyl)-3-pyrrolidinyl]methyl]-4-piperidinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1-[[1-(naphthalene-1-carbonyl)-4-thiophen-3-ylpyrrolidin-3-yl]methyl]piperidin-4-yl]benzoate Traditional Name: 2-[1-[[1-(1-naphthoyl)-4-(3-thienyl)pyrrolidin-3-yl]methyl]-4-piperidyl]benzoic acid methyl ester Formula: C33H34N2O3S MolecularWeight: 538.69966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2CCN(CC2)CC3CN(CC3C4=CSC=C4)C(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2CCN(CC2)CC3CN(CC3C4=CSC=C4)C(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C33H34N2O3S/c1-38-33(37)30-11-5-4-10-28(30)24-13-16-34(17-14-24)19-26-20-35(21-31(26)25-15-18-39-22-25)32(36)29-12-6-8-23-7-2-3-9-27(23)29/h2-12,15,18,22,24,26,31H,13-14,16-17,19-21H2,1H3