ethanedioic acid; 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: ethanedioic acid; 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazin-1-yl)-1-(2-methylindolin-1-yl)ethanone; oxalic acid CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-(phenylmethyl)-1-piperazinyl]ethanone; oxalic acid IUPAC Name: 2-(4-benzylpiperazin-1-yl)-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone; oxalic acid Traditional Name: 2-(4-benzylpiperazino)-1-(2-methylindolin-1-yl)ethanone; oxalic acid Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CN3CCN(CC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CN3CCN(CC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H27N3O.C2H2O4/c1-18-15-20-9-5-6-10-21(20)25(18)22(26)17-24-13-11-23(12-14-24)16-19-7-3-2-4-8-19;3-1(4)2(5)6/h2-10,18H,11-17H2,1H3;(H,3,4)(H,5,6)