(2S)-2-[2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]ethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoylamino]ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-[3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[[3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoylamino]acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propanoylamino]acetyl]amino]-3-methyl-butyrate Formula: C21H25N2O7- MolecularWeight: 417.4324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C21H26N2O7/c1-11(2)19(20(26)27)23-18(25)10-22-17(24)8-7-15-12(3)14-6-5-13(29-4)9-16(14)30-21(15)28/h5-6,9,11,19H,7-8,10H2,1-4H3,(H,22,24)(H,23,25)(H,26,27)/p-1/t19-/m0/s1