5-chloranyl-3-methyl-N-[4-(3-methylbutanoylamino)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[4-(3-methylbutanoylamino)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-3-methyl-N-[4-(3-methylbutanoylamino)phenyl]benzofuran-2-carboxamide CAS Name: 5-chloro-3-methyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-benzofurancarboxamide IUPAC Name: 5-chloro-3-methyl-N-[4-(3-methylbutanoylamino)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[4-(isovalerylamino)phenyl]-3-methyl-coumarilamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

InChI

InChI=1S/C21H21ClN2O3/c1-12(2)10-19(25)23-15-5-7-16(8-6-15)24-21(26)20-13(3)17-11-14(22)4-9-18(17)27-20/h4-9,11-12H,10H2,1-3H3,(H,23,25)(H,24,26)