methyl 5-chloranyl-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate CAS Name: 5-chloro-3-[[2-[4-(2-hydroxyethyl)-1-piperazinyl]-1-oxopropyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazino]propanoylamino]-1H-indole-2-carboxylic acid methyl ester Formula: C19H25ClN4O4 MolecularWeight: 408.8792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(NC2=C1C=C(C=C2)Cl)C(=O)OC)N3CCN(CC3)CCO

Isomeric SMILES

CC(C(=O)NC1=C(NC2=C1C=C(C=C2)Cl)C(=O)OC)N3CCN(CC3)CCO

InChI

InChI=1S/C19H25ClN4O4/c1-12(24-7-5-23(6-8-24)9-10-25)18(26)22-16-14-11-13(20)3-4-15(14)21-17(16)19(27)28-2/h3-4,11-12,21,25H,5-10H2,1-2H3,(H,22,26)