6-[2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethanoyl]naphthalene-2-carboxylic acid Openeye Name: 6-[2-[(2R)-4-benzoyl-2-methyl-piperazin-1-yl]-2-oxo-acetyl]naphthalene-2-carboxylic acid CAS Name: 6-[2-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-1,2-dioxoethyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[2-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-oxoacetyl]naphthalene-2-carboxylic acid Traditional Name: 6-[2-[(2R)-4-benzoyl-2-methyl-piperazino]-2-keto-acetyl]-2-naphthoic acid Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)C(=O)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O5/c1-16-15-26(23(29)17-5-3-2-4-6-17)11-12-27(16)24(30)22(28)20-9-7-19-14-21(25(31)32)10-8-18(19)13-20/h2-10,13-14,16H,11-12,15H2,1H3,(H,31,32)/t16-/m1/s1