2-[[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]naphthalen-2-yl]carbonylamino]-2-methyl-propanoic acid

Systemtic Name: 2-[[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]naphthalen-2-yl]carbonylamino]-2-methyl-propanoic acid Openeye Name: 2-[[1-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]naphthalene-2-carbonyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[[1-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-2-naphthalenyl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[1-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]naphthalene-2-carbonyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[1-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-2-naphthoyl]amino]-2-methyl-propionic acid Formula: C23H20ClNO6 MolecularWeight: 441.861

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C23H20ClNO6/c1-23(2,22(27)28)25-21(26)16-8-7-13-5-3-4-6-15(13)20(16)29-11-14-9-18-19(10-17(14)24)31-12-30-18/h3-10H,11-12H2,1-2H3,(H,25,26)(H,27,28)