2-[5-(2-dimethylaminoethyloxy)-6-oxidanylidene-4-propan-2-yl-cyclohexa-2,4-dien-1-yl]-3-propyl-nonanoic acid

Systemtic Name: 2-[5-(2-dimethylaminoethyloxy)-6-oxidanylidene-4-propan-2-yl-cyclohexa-2,4-dien-1-yl]-3-propyl-nonanoic acid Openeye Name: 2-[5-(2-dimethylaminoethyloxy)-4-isopropyl-6-oxo-cyclohexa-2,4-dien-1-yl]-3-propyl-nonanoic acid CAS Name: 2-[5-(2-dimethylaminoethyloxy)-6-oxo-4-propan-2-yl-1-cyclohexa-2,4-dienyl]-3-propylnonanoic acid IUPAC Name: 2-[5-(2-dimethylaminoethyloxy)-6-oxo-4-propan-2-ylcyclohexa-2,4-dien-1-yl]-3-propylnonanoic acid Traditional Name: 2-[5-(2-dimethylaminoethyloxy)-4-isopropyl-6-keto-cyclohexa-2,4-dien-1-yl]-3-propyl-pelargonic acid Formula: C25H43NO4 MolecularWeight: 421.61322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC)C(C1C=CC(=C(C1=O)OCCN(C)C)C(C)C)C(=O)O

Isomeric SMILES

CCCCCCC(CCC)C(C1C=CC(=C(C1=O)OCCN(C)C)C(C)C)C(=O)O

InChI

InChI=1S/C25H43NO4/c1-7-9-10-11-13-19(12-8-2)22(25(28)29)21-15-14-20(18(3)4)24(23(21)27)30-17-16-26(5)6/h14-15,18-19,21-22H,7-13,16-17H2,1-6H3,(H,28,29)