ethyl 5-[2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-3-carboxylate

Systemtic Name: ethyl 5-[2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-3-carboxylate Openeye Name: ethyl 5-[2-[(2R)-4-benzoyl-2-methyl-piperazin-1-yl]-2-oxo-acetyl]-1H-indole-3-carboxylate CAS Name: 5-[2-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-1,2-dioxoethyl]-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-oxoacetyl]-1H-indole-3-carboxylate Traditional Name: 5-[2-[(2R)-4-benzoyl-2-methyl-piperazino]-2-keto-acetyl]-1H-indole-3-carboxylic acid ethyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C1C=C(C=C2)C(=O)C(=O)N3CCN(CC3C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CNC2=C1C=C(C=C2)C(=O)C(=O)N3CCN(C[C@H]3C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O5/c1-3-33-25(32)20-14-26-21-10-9-18(13-19(20)21)22(29)24(31)28-12-11-27(15-16(28)2)23(30)17-7-5-4-6-8-17/h4-10,13-14,16,26H,3,11-12,15H2,1-2H3/t16-/m1/s1