(2S)-2-[2-[2-(4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]ethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[2-(4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-[[2-(4-butyl-7-methyl-2-oxo-chromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[[2-[(4-butyl-7-methyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[[2-(4-butyl-7-methyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[[2-(4-butyl-2-keto-7-methyl-chromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butyrate Formula: C23H29N2O7- MolecularWeight: 445.48556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)NCC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C23H30N2O7/c1-5-6-7-15-10-20(28)32-17-9-14(4)8-16(21(15)17)31-12-19(27)24-11-18(26)25-22(13(2)3)23(29)30/h8-10,13,22H,5-7,11-12H2,1-4H3,(H,24,27)(H,25,26)(H,29,30)/p-1/t22-/m0/s1