methyl 2,2-dimethyl-5-[(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)amino]-4-[(3-methylphenyl)methyl]-4-oxidanyl-5-oxidanylidene-pentanoate

Systemtic Name: methyl 2,2-dimethyl-5-[(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)amino]-4-[(3-methylphenyl)methyl]-4-oxidanyl-5-oxidanylidene-pentanoate Openeye Name: methyl 4-hydroxy-2,2-dimethyl-5-[(4-methyl-1-oxo-2,3-benzoxazin-6-yl)amino]-4-(m-tolylmethyl)-5-oxo-pentanoate CAS Name: 4-hydroxy-2,2-dimethyl-5-[(4-methyl-1-oxo-2,3-benzoxazin-6-yl)amino]-4-[(3-methylphenyl)methyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 4-hydroxy-2,2-dimethyl-5-[(4-methyl-1-oxo-2,3-benzoxazin-6-yl)amino]-4-[(3-methylphenyl)methyl]-5-oxopentanoate Traditional Name: 4-hydroxy-5-keto-5-[(1-keto-4-methyl-2,3-benzoxazin-6-yl)amino]-2,2-dimethyl-4-(3-methylbenzyl)valeric acid methyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(CC(C)(C)C(=O)OC)(C(=O)NC2=CC3=C(C=C2)C(=O)ON=C3C)O

Isomeric SMILES

CC1=CC(=CC=C1)CC(CC(C)(C)C(=O)OC)(C(=O)NC2=CC3=C(C=C2)C(=O)ON=C3C)O

InChI

InChI=1S/C25H28N2O6/c1-15-7-6-8-17(11-15)13-25(31,14-24(3,4)23(30)32-5)22(29)26-18-9-10-19-20(12-18)16(2)27-33-21(19)28/h6-12,31H,13-14H2,1-5H3,(H,26,29)