(2S)-3-phenyl-2-[2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propanoate

Systemtic Name: (2S)-3-phenyl-2-[2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propanoate Openeye Name: (2S)-3-phenyl-2-[[2-(3,4,8-trimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]propanoate CAS Name: (2S)-2-[[1-oxo-2-[(3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl)oxy]ethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-3-phenyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoate Traditional Name: (2S)-2-[[2-(2-keto-3,4,8-trimethyl-chromen-7-yl)oxyacetyl]amino]-3-phenyl-propionate Formula: C23H22NO6- MolecularWeight: 408.42388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(CC3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C23H23NO6/c1-13-14(2)23(28)30-21-15(3)19(10-9-17(13)21)29-12-20(25)24-18(22(26)27)11-16-7-5-4-6-8-16/h4-10,18H,11-12H2,1-3H3,(H,24,25)(H,26,27)/p-1/t18-/m0/s1