7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-oxidanylidene-prop-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-oxidanylidene-prop-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-oxo-prop-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[(1S,2S)-2-[3-(4-dimethylaminophenyl)-3-keto-prop-1-enyl]-5-keto-cyclopentyl]enanthic acid Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO4/c1-24(2)19-13-9-18(10-14-19)21(25)15-11-17-12-16-22(26)20(17)7-5-3-4-6-8-23(27)28/h9-11,13-15,17,20H,3-8,12,16H2,1-2H3,(H,27,28)/t17-,20+/m1/s1