ethanedioic acid; 1-(1H-indol-3-yl)-2-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: ethanedioic acid; 1-(1H-indol-3-yl)-2-[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-(1H-indol-3-yl)-2-phenyl-2-[4-(tetrahydrofuran-2-carbonyl)piperazin-1-yl]ethanone; oxalic acid CAS Name: 1-(1H-indol-3-yl)-2-[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]-2-phenylethanone; oxalic acid IUPAC Name: 1-(1H-indol-3-yl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]-2-phenylethanone; oxalic acid Traditional Name: 1-(1H-indol-3-yl)-2-phenyl-2-[4-(tetrahydrofuran-2-carbonyl)piperazino]ethanone; oxalic acid Formula: C27H29N3O7 MolecularWeight: 507.53506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(OC1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H27N3O3.C2H2O4/c29-24(20-17-26-21-10-5-4-9-19(20)21)23(18-7-2-1-3-8-18)27-12-14-28(15-13-27)25(30)22-11-6-16-31-22;3-1(4)2(5)6/h1-5,7-10,17,22-23,26H,6,11-16H2;(H,3,4)(H,5,6)