1-[4-[2-(octylcarbamoyl)cyclopropyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[4-[2-(octylcarbamoyl)cyclopropyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: 1-[4-[2-(octylcarbamoyl)cyclopropyl]phenyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 1-[4-[2-[(octylamino)-oxomethyl]cyclopropyl]phenyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[2-(octylcarbamoyl)cyclopropyl]phenyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 5-keto-1-[4-[2-(octylcarbamoyl)cyclopropyl]phenyl]pyrrolidine-3-carboxylic acid Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1CC1C2=CC=C(C=C2)N3CC(CC3=O)C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)C1CC1C2=CC=C(C=C2)N3CC(CC3=O)C(=O)O

InChI

InChI=1S/C23H32N2O4/c1-2-3-4-5-6-7-12-24-22(27)20-14-19(20)16-8-10-18(11-9-16)25-15-17(23(28)29)13-21(25)26/h8-11,17,19-20H,2-7,12-15H2,1H3,(H,24,27)(H,28,29)