(2S)-2-[2-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[2-(7,8-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[2-(7,8-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-(7,8-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[2-(7,8-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(2-keto-7,8-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]-3-phenyl-propionate Formula: C23H22NO7- MolecularWeight: 424.42328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2OC)OC)CC(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2OC)OC)CC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C23H23NO7/c1-13-15-9-10-18(29-2)21(30-3)20(15)31-23(28)16(13)12-19(25)24-17(22(26)27)11-14-7-5-4-6-8-14/h4-10,17H,11-12H2,1-3H3,(H,24,25)(H,26,27)/p-1/t17-/m0/s1