N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzamide CAS Name: N-(2-amino-2-oxoethyl)-3-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[4-(4-chloro-2-methylphenoxy)butanoylamino]benzamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzamide Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)N

InChI

InChI=1S/C20H22ClN3O4/c1-13-10-15(21)7-8-17(13)28-9-3-6-19(26)24-16-5-2-4-14(11-16)20(27)23-12-18(22)25/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3,(H2,22,25)(H,23,27)(H,24,26)