2-oxidanylidene-2-[1-[(E)-3-[4-(4-phenylbutoxy)phenyl]prop-2-enoyl]pyrrolidin-2-yl]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[1-[(E)-3-[4-(4-phenylbutoxy)phenyl]prop-2-enoyl]pyrrolidin-2-yl]ethanoic acid Openeye Name: 2-oxo-2-[1-[(E)-3-[4-(4-phenylbutoxy)phenyl]prop-2-enoyl]pyrrolidin-2-yl]acetic acid CAS Name: 2-oxo-2-[1-[(E)-1-oxo-3-[4-(4-phenylbutoxy)phenyl]prop-2-enyl]-2-pyrrolidinyl]acetic acid IUPAC Name: 2-oxo-2-[1-[(E)-3-[4-(4-phenylbutoxy)phenyl]prop-2-enoyl]pyrrolidin-2-yl]acetic acid Traditional Name: 2-keto-2-[1-[(E)-3-[4-(4-phenylbutoxy)phenyl]acryloyl]pyrrolidin-2-yl]acetic acid Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C=CC2=CC=C(C=C2)OCCCCC3=CC=CC=C3)C(=O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)/C=C/C2=CC=C(C=C2)OCCCCC3=CC=CC=C3)C(=O)C(=O)O

InChI

InChI=1S/C25H27NO5/c27-23(26-17-6-10-22(26)24(28)25(29)30)16-13-20-11-14-21(15-12-20)31-18-5-4-9-19-7-2-1-3-8-19/h1-3,7-8,11-16,22H,4-6,9-10,17-18H2,(H,29,30)/b16-13+