5-chloranyl-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-[4-(2-furoyl)piperazino]-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)C(=O)C4=CC=CO4

InChI

InChI=1S/C20H18ClN3O5/c21-12-3-4-15-13(10-12)14(18(22-15)20(27)28)11-17(25)23-5-7-24(8-6-23)19(26)16-2-1-9-29-16/h1-4,9-10,22H,5-8,11H2,(H,27,28)