3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]propyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]propyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]propyl]-1H-indole-5-carboxylic acid CAS Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]propyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]propyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]propyl]-1H-indole-5-carboxylic acid Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CNC3=C2C=C(C=C3)C(=O)O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1CCCC2=CNC3=C2C=C(C=C3)C(=O)O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H27N3O4/c28-24(29)17-3-5-21-20(14-17)18(16-25-21)2-1-7-26-8-10-27(11-9-26)19-4-6-22-23(15-19)31-13-12-30-22/h3-6,14-16,25H,1-2,7-13H2,(H,28,29)