(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2S)-3-methyl-2-(phenylcarbamoylamino)butyric acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(C(C)C)NC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)[C@H](C(C)C)NC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C24H26N2O5/c1-14(2)22(26-24(29)25-18-8-6-5-7-9-18)23(28)30-13-17-12-21(27)31-20-11-16(4)15(3)10-19(17)20/h5-12,14,22H,13H2,1-4H3,(H2,25,26,29)/t22-/m0/s1