4-[4-(4-chloranyl-3-methyl-phenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[4-(4-chloranyl-3-methyl-phenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[4-(4-chloro-3-methyl-phenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[4-(4-chloro-3-methylphenoxy)-1-oxobutyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[4-(4-chloro-3-methylphenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[4-(4-chloro-3-methyl-phenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-14-12-15(9-10-16(14)22)27-11-5-8-20(25)24-13-19(21(26)23-2)28-18-7-4-3-6-17(18)24/h3-4,6-7,9-10,12,19H,5,8,11,13H2,1-2H3,(H,23,26)