(2S)-2-[2-[4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-[4-(4-methoxyphenyl)-2-oxo-chromen-7-yl]oxyacetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[[4-(4-methoxyphenyl)-2-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[4-(4-methoxyphenyl)-2-oxochromen-7-yl]oxyacetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[2-keto-4-(4-methoxyphenyl)chromen-7-yl]oxyacetyl]amino]-3-methyl-butyrate Formula: C23H22NO7- MolecularWeight: 424.42328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H23NO7/c1-13(2)22(23(27)28)24-20(25)12-30-16-8-9-17-18(11-21(26)31-19(17)10-16)14-4-6-15(29-3)7-5-14/h4-11,13,22H,12H2,1-3H3,(H,24,25)(H,27,28)/p-1/t22-/m0/s1