7-[(1S,2S)-2-[2-(4-acetamidophenyl)ethenyl]-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1S,2S)-2-[2-(4-acetamidophenyl)ethenyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[(1S,2S)-2-[2-(4-acetamidophenyl)vinyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[(1S,2S)-2-[2-(4-acetamidophenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[(1S,2S)-2-[2-(4-acetamidophenyl)ethenyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[(1S,2S)-2-[2-(4-acetamidophenyl)vinyl]-5-keto-cyclopentyl]enanthic acid Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=CC2CCC(=O)C2CCCCCCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C=C[C@@H]2CCC(=O)[C@H]2CCCCCCC(=O)O

InChI

InChI=1S/C22H29NO4/c1-16(24)23-19-13-9-17(10-14-19)8-11-18-12-15-21(25)20(18)6-4-2-3-5-7-22(26)27/h8-11,13-14,18,20H,2-7,12,15H2,1H3,(H,23,24)(H,26,27)/t18-,20+/m1/s1