3-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]naphthalene-2-carboxylic acid

Systemtic Name: 3-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]naphthalene-2-carboxylic acid Openeye Name: 3-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]naphthalene-2-carboxylic acid CAS Name: 3-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-2-naphthalenecarboxylic acid IUPAC Name: 3-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]naphthalene-2-carboxylic acid Traditional Name: 3-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-2-naphthoic acid Formula: C24H23ClN2O4 MolecularWeight: 438.90342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC4=CC=CC=C4C=C3C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC4=CC=CC=C4C=C3C(=O)O

InChI

InChI=1S/C24H23ClN2O4/c25-20-7-5-17(6-8-20)15-26-9-11-27(12-10-26)23(28)16-31-22-14-19-4-2-1-3-18(19)13-21(22)24(29)30/h1-8,13-14H,9-12,15-16H2,(H,29,30)