4-[2-[3-(1-heptan-4-ylindol-5-yl)pentanoylamino]phenoxy]butanoic acid

Systemtic Name: 4-[2-[3-(1-heptan-4-ylindol-5-yl)pentanoylamino]phenoxy]butanoic acid Openeye Name: 4-[2-[3-[1-(1-propylbutyl)indol-5-yl]pentanoylamino]phenoxy]butanoic acid CAS Name: 4-[2-[[3-(1-heptan-4-yl-5-indolyl)-1-oxopentyl]amino]phenoxy]butanoic acid IUPAC Name: 4-[2-[3-(1-heptan-4-ylindol-5-yl)pentanoylamino]phenoxy]butanoic acid Traditional Name: 4-[2-[3-[1-(1-propylbutyl)indol-5-yl]pentanoylamino]phenoxy]butyric acid Formula: C30H40N2O4 MolecularWeight: 492.6496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C=CC2=C1C=CC(=C2)C(CC)CC(=O)NC3=CC=CC=C3OCCCC(=O)O

Isomeric SMILES

CCCC(CCC)N1C=CC2=C1C=CC(=C2)C(CC)CC(=O)NC3=CC=CC=C3OCCCC(=O)O

InChI

InChI=1S/C30H40N2O4/c1-4-10-25(11-5-2)32-18-17-24-20-23(15-16-27(24)32)22(6-3)21-29(33)31-26-12-7-8-13-28(26)36-19-9-14-30(34)35/h7-8,12-13,15-18,20,22,25H,4-6,9-11,14,19,21H2,1-3H3,(H,31,33)(H,34,35)