1-[(3-ethoxy-4-phenylmethoxy-phenyl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-(3,4,5-trimethoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-(3,4,5-trimethoxyphenyl)methyl]proline Formula: C30H35NO7 MolecularWeight: 521.6014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC(=C(C(=C2)OC)OC)OC)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC(=C(C(=C2)OC)OC)OC)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H35NO7/c1-5-37-25-16-21(13-14-24(25)38-19-20-10-7-6-8-11-20)28(31-15-9-12-23(31)30(32)33)22-17-26(34-2)29(36-4)27(18-22)35-3/h6-8,10-11,13-14,16-18,23,28H,5,9,12,15,19H2,1-4H3,(H,32,33)