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4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butanoic acid

4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butanoic acid

Systemtic Name:4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butanoic acid
Openeye Name:4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butanoic acid
CAS Name:4-[3-(3-heptyl-1-oxodec-2-enyl)-1-indolyl]butanoic acid
IUPAC Name:4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butanoic acid
Traditional Name:4-[3-(3-heptyldec-2-enoyl)indol-1-yl]butyric acid
Formula: C29H43NO3
MolecularWeight: 453.65662
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=CC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)O)CCCCCCC


Isomeric SMILES

CCCCCCCC(=CC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)O)CCCCCCC


InChI

InChI=1S/C29H43NO3/c1-3-5-7-9-11-16-24(17-12-10-8-6-4-2)22-28(31)26-23-30(21-15-20-29(32)33)27-19-14-13-18-25(26)27/h13-14,18-19,22-23H,3-12,15-17,20-21H2,1-2H3,(H,32,33)


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