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

Systemtic Name: 2-[[1-[(5-chloranyl-1-benzothiophen-3-yl)methoxy]naphthalen-2-yl]carbonylamino]-2-methyl-propanoic acid Openeye Name: 2-[[1-[(5-chlorobenzothiophen-3-yl)methoxy]naphthalene-2-carbonyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[[1-[(5-chloro-1-benzothiophen-3-yl)methoxy]-2-naphthalenyl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[1-[(5-chloro-1-benzothiophen-3-yl)methoxy]naphthalene-2-carbonyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[1-[(5-chlorobenzothiophen-3-yl)methoxy]-2-naphthoyl]amino]-2-methyl-propionic acid Formula: C24H20ClNO4S MolecularWeight: 453.9379

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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=CSC4=C3C=C(C=C4)Cl

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C24H20ClNO4S/c1-24(2,23(28)29)26-22(27)18-9-7-14-5-3-4-6-17(14)21(18)30-12-15-13-31-20-10-8-16(25)11-19(15)20/h3-11,13H,12H2,1-2H3,(H,26,27)(H,28,29)