4-[3-[[2-butyl-2-(4-propylphenyl)-1,3-benzodioxol-5-yl]carbonyl]-2-methyl-indol-1-yl]butanoic acid

Systemtic Name: 4-[3-[[2-butyl-2-(4-propylphenyl)-1,3-benzodioxol-5-yl]carbonyl]-2-methyl-indol-1-yl]butanoic acid Openeye Name: 4-[3-[2-butyl-2-(4-propylphenyl)-1,3-benzodioxole-5-carbonyl]-2-methyl-indol-1-yl]butanoic acid CAS Name: 4-[3-[[2-butyl-2-(4-propylphenyl)-1,3-benzodioxol-5-yl]-oxomethyl]-2-methyl-1-indolyl]butanoic acid IUPAC Name: 4-[3-[2-butyl-2-(4-propylphenyl)-1,3-benzodioxole-5-carbonyl]-2-methylindol-1-yl]butanoic acid Traditional Name: 4-[3-[2-butyl-2-(4-propylphenyl)piperonyloyl]-2-methyl-indol-1-yl]butyric acid Formula: C34H37NO5 MolecularWeight: 539.66128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC2=C(O1)C=C(C=C2)C(=O)C3=C(N(C4=CC=CC=C43)CCCC(=O)O)C)C5=CC=C(C=C5)CCC

Isomeric SMILES

CCCCC1(OC2=C(O1)C=C(C=C2)C(=O)C3=C(N(C4=CC=CC=C43)CCCC(=O)O)C)C5=CC=C(C=C5)CCC

InChI

InChI=1S/C34H37NO5/c1-4-6-20-34(26-17-14-24(10-5-2)15-18-26)39-29-19-16-25(22-30(29)40-34)33(38)32-23(3)35(21-9-13-31(36)37)28-12-8-7-11-27(28)32/h7-8,11-12,14-19,22H,4-6,9-10,13,20-21H2,1-3H3,(H,36,37)