2-(phenylmethyl)-1-[[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-2-yl]methoxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(phenylmethyl)-1-[[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-2-yl]methoxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[1-[(4-allyloxyphenyl)methyl]-2-piperidyl]methoxycarbonyl]-2-benzyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[oxo-[[1-[(4-prop-2-enoxyphenyl)methyl]-2-piperidinyl]methoxy]methyl]-2-(phenylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 2-benzyl-1-[[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-2-yl]methoxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[1-(4-allyloxybenzyl)-2-piperidyl]methoxycarbonyl]-2-benzyl-proline Formula: C29H36N2O5 MolecularWeight: 492.60654

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)CN2CCCCC2COC(=O)N3CCCC3(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C=CCOC1=CC=C(C=C1)CN2CCCCC2COC(=O)N3CCCC3(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H36N2O5/c1-2-19-35-26-14-12-24(13-15-26)21-30-17-7-6-11-25(30)22-36-28(34)31-18-8-16-29(31,27(32)33)20-23-9-4-3-5-10-23/h2-5,9-10,12-15,25H,1,6-8,11,16-22H2,(H,32,33)