[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: [2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: [2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionic acid [2-keto-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)CCN2C3=CC=CC=C3OC(C2=O)C

Isomeric SMILES

CC1CCCCC1NC(=O)COC(=O)CCN2C3=CC=CC=C3OC(C2=O)C

InChI

InChI=1S/C21H28N2O5/c1-14-7-3-4-8-16(14)22-19(24)13-27-20(25)11-12-23-17-9-5-6-10-18(17)28-15(2)21(23)26/h5-6,9-10,14-16H,3-4,7-8,11-13H2,1-2H3,(H,22,24)