methyl 3-[2-[2-(hydroxymethyl)-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-4-carboxylate

Systemtic Name: methyl 3-[2-[2-(hydroxymethyl)-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-4-carboxylate Openeye Name: methyl 3-[2-[4-benzoyl-2-(hydroxymethyl)piperazin-1-yl]-2-oxo-acetyl]-1H-indole-4-carboxylate CAS Name: 3-[2-[4-benzoyl-2-(hydroxymethyl)-1-piperazinyl]-1,2-dioxoethyl]-1H-indole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-[4-benzoyl-2-(hydroxymethyl)piperazin-1-yl]-2-oxoacetyl]-1H-indole-4-carboxylate Traditional Name: 3-[2-(4-benzoyl-2-methylol-piperazino)-2-keto-acetyl]-1H-indole-4-carboxylic acid methyl ester Formula: C24H23N3O6 MolecularWeight: 449.45592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)NC=C2C(=O)C(=O)N3CCN(CC3CO)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)NC=C2C(=O)C(=O)N3CCN(CC3CO)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O6/c1-33-24(32)17-8-5-9-19-20(17)18(12-25-19)21(29)23(31)27-11-10-26(13-16(27)14-28)22(30)15-6-3-2-4-7-15/h2-9,12,16,25,28H,10-11,13-14H2,1H3