2-[[4-chloranyl-1-(2-methyl-1-piperidin-4-yl-propoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid

Systemtic Name: 2-[[4-chloranyl-1-(2-methyl-1-piperidin-4-yl-propoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid Openeye Name: 2-[[4-chloro-1-[2-methyl-1-(4-piperidyl)propoxy]naphthalene-2-carbonyl]amino]-2-methyl-butanoic acid CAS Name: 2-[[[4-chloro-1-[2-methyl-1-(4-piperidinyl)propoxy]-2-naphthalenyl]-oxomethyl]amino]-2-methylbutanoic acid IUPAC Name: 2-[[4-chloro-1-(2-methyl-1-piperidin-4-ylpropoxy)naphthalene-2-carbonyl]amino]-2-methylbutanoic acid Traditional Name: 2-[[4-chloro-1-[2-methyl-1-(4-piperidyl)propoxy]-2-naphthoyl]amino]-2-methyl-butyric acid Formula: C25H33ClN2O4 MolecularWeight: 460.99352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C(=C1)Cl)OC(C3CCNCC3)C(C)C

Isomeric SMILES

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C(=C1)Cl)OC(C3CCNCC3)C(C)C

InChI

InChI=1S/C25H33ClN2O4/c1-5-25(4,24(30)31)28-23(29)19-14-20(26)17-8-6-7-9-18(17)22(19)32-21(15(2)3)16-10-12-27-13-11-16/h6-9,14-16,21,27H,5,10-13H2,1-4H3,(H,28,29)(H,30,31)