ethyl 4-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(1H-indole-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-quinoline-3-carboxylate CAS Name: 4-[4-[1H-indol-2-yl(oxo)methyl]-1-piperazinyl]-1-methyl-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(1H-indole-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxoquinoline-3-carboxylate Traditional Name: 4-[4-(1H-indole-2-carbonyl)piperazino]-2-keto-1-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C26H26N4O4/c1-3-34-26(33)22-23(18-9-5-7-11-21(18)28(2)25(22)32)29-12-14-30(15-13-29)24(31)20-16-17-8-4-6-10-19(17)27-20/h4-11,16,27H,3,12-15H2,1-2H3