(2S)-2-[[(2S)-2-(3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[(2S)-2-(3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[(2S)-2-(3,4-dimethyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-2-[(3,4-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[(2S)-2-(3,4-dimethyl-2-oxochromen-7-yl)oxypropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-2-(2-keto-3,4-dimethyl-chromen-7-yl)oxypropanoyl]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(=C2)OC(C)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O[C@@H](C)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C23H23NO6/c1-13-14(2)23(28)30-20-12-17(9-10-18(13)20)29-15(3)21(25)24-19(22(26)27)11-16-7-5-4-6-8-16/h4-10,12,15,19H,11H2,1-3H3,(H,24,25)(H,26,27)/p-1/t15-,19-/m0/s1