[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-[(4-ethoxyphenyl)methyl]piperidin-4-yl]methanone; ethanedioic acid

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-[(4-ethoxyphenyl)methyl]piperidin-4-yl]methanone; ethanedioic acid Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-[(4-ethoxyphenyl)methyl]-4-piperidyl]methanone; oxalic acid CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-[(4-ethoxyphenyl)methyl]-4-piperidinyl]methanone; oxalic acid IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-[(4-ethoxyphenyl)methyl]piperidin-4-yl]methanone; oxalic acid Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[1-(4-ethoxybenzyl)-4-piperidyl]methanone; oxalic acid Formula: C29H39N3O6 MolecularWeight: 525.63646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC(=C4C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC(=C4C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H37N3O2.C2H2O4/c1-4-32-25-10-8-23(9-11-25)20-28-14-12-24(13-15-28)27(31)30-18-16-29(17-19-30)26-7-5-6-21(2)22(26)3;3-1(4)2(5)6/h5-11,24H,4,12-20H2,1-3H3;(H,3,4)(H,5,6)