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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (2S)-2-benzamidopropanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic 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-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO5/c1-14(2)19-12-20-18(11-22(26)30-21(20)10-15(19)3)13-29-24(28)16(4)25-23(27)17-8-6-5-7-9-17/h5-12,14,16H,13H2,1-4H3,(H,25,27)/t16-/m0/s1