methyl 3-[3-(4-methylphenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[3-(4-methylphenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-oxo-3-[3-(1-piperidylmethyl)-4-(p-tolyl)pyrrolidin-1-yl]propanoate CAS Name: 3-[3-(4-methylphenyl)-4-(1-piperidinylmethyl)-1-pyrrolidinyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-methylphenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-oxopropanoate Traditional Name: 3-keto-3-[3-(piperidinomethyl)-4-(p-tolyl)pyrrolidino]propionic acid methyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2CN3CCCCC3)C(=O)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2CN3CCCCC3)C(=O)CC(=O)OC

InChI

InChI=1S/C21H30N2O3/c1-16-6-8-17(9-7-16)19-15-23(20(24)12-21(25)26-2)14-18(19)13-22-10-4-3-5-11-22/h6-9,18-19H,3-5,10-15H2,1-2H3