(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C(C)C)NC(=O)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)[C@H](C(C)C)NC(=O)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C29H29NO5/c1-17(2)27(30-25(31)14-21-10-7-9-20-8-5-6-11-23(20)21)29(33)34-16-22-15-26(32)35-28-19(4)18(3)12-13-24(22)28/h5-13,15,17,27H,14,16H2,1-4H3,(H,30,31)/t27-/m0/s1