N-cyclopentyl-4-methyl-pentanamide; 2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: N-cyclopentyl-4-methyl-pentanamide; 2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: N-cyclopentyl-4-methyl-pentanamide; 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid CAS Name: N-cyclopentyl-4-methylpentanamide; 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: N-cyclopentyl-4-methylpentanamide; 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid Traditional Name: N-cyclopentyl-4-methyl-valeramide; 2-(3-keto-6-methyl-1,4-benzoxazin-4-yl)acetic acid Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CC(=O)O.CC(C)CCC(=O)NC1CCCC1

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CC(=O)O.CC(C)CCC(=O)NC1CCCC1

InChI

InChI=1S/C11H11NO4.C11H21NO/c1-7-2-3-9-8(4-7)12(5-11(14)15)10(13)6-16-9;1-9(2)7-8-11(13)12-10-5-3-4-6-10/h2-4H,5-6H2,1H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,12,13)