methyl 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-morpholin-4-yl-piperidin-3-yl]propanoate

Systemtic Name: methyl 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-morpholin-4-yl-piperidin-3-yl]propanoate Openeye Name: methyl 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-morpholino-3-piperidyl]propanoate CAS Name: 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-(4-morpholinyl)-3-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-morpholin-4-ylpiperidin-3-yl]propanoate Traditional Name: 3-[(3S,4R)-1-(2,2-diphenylethyl)-4-morpholino-3-piperidyl]propionic acid methyl ester Formula: C27H36N2O3 MolecularWeight: 436.58634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1CN(CCC1N2CCOCC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC[C@H]1CN(CC[C@H]1N2CCOCC2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H36N2O3/c1-31-27(30)13-12-24-20-28(15-14-26(24)29-16-18-32-19-17-29)21-25(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-11,24-26H,12-21H2,1H3/t24-,26+/m0/s1