methyl 4-[3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]butanoate

Systemtic Name: methyl 4-[3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]butanoate Openeye Name: methyl 4-[3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoylamino]butanoate CAS Name: 4-[[3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoylamino]butanoate Traditional Name: 4-[3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propanoylamino]butyric acid methyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCCC(=O)OC

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C17H22N2O5/c1-12-17(22)19(13-6-3-4-7-14(13)24-12)11-9-15(20)18-10-5-8-16(21)23-2/h3-4,6-7,12H,5,8-11H2,1-2H3,(H,18,20)