(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C)NC(=O)NC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)[C@H](C)NC(=O)NC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C24H26N2O5/c1-14(2)19-12-20-17(11-22(27)31-21(20)10-15(19)3)13-30-23(28)16(4)25-24(29)26-18-8-6-5-7-9-18/h5-12,14,16H,13H2,1-4H3,(H2,25,26,29)/t16-/m0/s1