4-azanyl-1-[[3,4-bis(phenylmethoxy)phenyl]methyl]pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 4-azanyl-1-[[3,4-bis(phenylmethoxy)phenyl]methyl]pyrrolidine-2,4-dicarboxylic acid Openeye Name: 4-amino-1-[(3,4-dibenzyloxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid CAS Name: 4-amino-1-[[3,4-bis(phenylmethoxy)phenyl]methyl]pyrrolidine-2,4-dicarboxylic acid IUPAC Name: 4-amino-1-[[3,4-bis(phenylmethoxy)phenyl]methyl]pyrrolidine-2,4-dicarboxylic acid Traditional Name: 4-amino-1-(3,4-dibenzoxybenzyl)pyrrolidine-2,4-dicarboxylic acid Formula: C27H28N2O6 MolecularWeight: 476.52102

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1(C(=O)O)N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(N(CC1(C(=O)O)N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H28N2O6/c28-27(26(32)33)14-22(25(30)31)29(18-27)15-21-11-12-23(34-16-19-7-3-1-4-8-19)24(13-21)35-17-20-9-5-2-6-10-20/h1-13,22H,14-18,28H2,(H,30,31)(H,32,33)