ethanedioic acid; [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: ethanedioic acid; [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazin-1-yl]-(3-pyridyl)methanone; oxalic acid CAS Name: [4-[(2-methoxy-1-naphthalenyl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone; oxalic acid IUPAC Name: [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-pyridin-3-ylmethanone; oxalic acid Traditional Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazino]-(3-pyridyl)methanone; oxalic acid Formula: C24H25N3O6 MolecularWeight: 451.4718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)C4=CN=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)C4=CN=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H23N3O2.C2H2O4/c1-27-21-9-8-17-5-2-3-7-19(17)20(21)16-24-11-13-25(14-12-24)22(26)18-6-4-10-23-15-18;3-1(4)2(5)6/h2-10,15H,11-14,16H2,1H3;(H,3,4)(H,5,6)