(Z)-2-(1-heptan-4-ylindol-5-yl)pent-2-enoic acid

Systemtic Name: (Z)-2-(1-heptan-4-ylindol-5-yl)pent-2-enoic acid Openeye Name: (Z)-2-[1-(1-propylbutyl)indol-5-yl]pent-2-enoic acid CAS Name: (Z)-2-(1-heptan-4-yl-5-indolyl)-2-pentenoic acid IUPAC Name: (Z)-2-(1-heptan-4-ylindol-5-yl)pent-2-enoic acid Traditional Name: (Z)-2-[1-(1-propylbutyl)indol-5-yl]pent-2-enoic acid Formula: C20H27NO2 MolecularWeight: 313.43388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C=CC2=C1C=CC(=C2)C(=CCC)C(=O)O

Isomeric SMILES

CCCC(CCC)N1C=CC2=C1C=CC(=C2)/C(=C/CC)/C(=O)O

InChI

InChI=1S/C20H27NO2/c1-4-7-17(8-5-2)21-13-12-16-14-15(10-11-19(16)21)18(9-6-3)20(22)23/h9-14,17H,4-8H2,1-3H3,(H,22,23)/b18-9-