1-[2-(dibutylamino)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-4-pyridin-3-yl-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[2-(dibutylamino)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-4-pyridin-3-yl-pyrrolidine-3-carboxylic acid Openeye Name: 1-[2-(dibutylamino)-2-oxo-ethyl]-2-(4-methoxyphenyl)-4-(3-pyridyl)pyrrolidine-3-carboxylic acid CAS Name: 1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-4-(3-pyridinyl)-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-4-pyridin-3-ylpyrrolidine-3-carboxylic acid Traditional Name: 1-[2-(dibutylamino)-2-keto-ethyl]-2-(4-methoxyphenyl)-4-(3-pyridyl)pyrrolidine-3-carboxylic acid Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)O)C3=CN=CC=C3

Isomeric SMILES

CCCCN(CCCC)C(=O)CN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C27H37N3O4/c1-4-6-15-29(16-7-5-2)24(31)19-30-18-23(21-9-8-14-28-17-21)25(27(32)33)26(30)20-10-12-22(34-3)13-11-20/h8-14,17,23,25-26H,4-7,15-16,18-19H2,1-3H3,(H,32,33)