4-azanyl-1-[(3,4-diphenoxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 4-azanyl-1-[(3,4-diphenoxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid Openeye Name: 4-amino-1-[(3,4-diphenoxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid CAS Name: 4-amino-1-[(3,4-diphenoxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid IUPAC Name: 4-amino-1-[(3,4-diphenoxyphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid Traditional Name: 4-amino-1-(3,4-diphenoxybenzyl)pyrrolidine-2,4-dicarboxylic acid Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1(C(=O)O)N)CC2=CC(=C(C=C2)OC3=CC=CC=C3)OC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(N(CC1(C(=O)O)N)CC2=CC(=C(C=C2)OC3=CC=CC=C3)OC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H24N2O6/c26-25(24(30)31)14-20(23(28)29)27(16-25)15-17-11-12-21(32-18-7-3-1-4-8-18)22(13-17)33-19-9-5-2-6-10-19/h1-13,20H,14-16,26H2,(H,28,29)(H,30,31)