5-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-1H-indole-3-carboxylic acid

Systemtic Name: 5-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-1H-indole-3-carboxylic acid Openeye Name: 5-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-1H-indole-3-carboxylic acid CAS Name: 5-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-1H-indole-3-carboxylic acid IUPAC Name: 5-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-1H-indole-3-carboxylic acid Traditional Name: 5-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-1H-indole-3-carboxylic acid Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC4=C(C=C3)NC=C4C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC4=C(C=C3)NC=C4C(=O)O

InChI

InChI=1S/C22H22ClN3O4/c23-16-3-1-15(2-4-16)13-25-7-9-26(10-8-25)21(27)14-30-17-5-6-20-18(11-17)19(12-24-20)22(28)29/h1-6,11-12,24H,7-10,13-14H2,(H,28,29)