(2R)-2-[2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[2-(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[[2-(6-chloro-2-oxo-4-propyl-chromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[2-[(6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[[2-(6-chloro-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[2-(6-chloro-2-keto-4-propyl-chromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propionate Formula: C25H22ClN2O7- MolecularWeight: 497.90438

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N[C@H](CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

InChI

InChI=1S/C25H23ClN2O7/c1-2-3-13-7-24(31)35-21-10-22(18(26)9-17(13)21)34-12-23(30)28-20(25(32)33)6-14-11-27-19-5-4-15(29)8-16(14)19/h4-5,7-11,20,27,29H,2-3,6,12H2,1H3,(H,28,30)(H,32,33)/p-1/t20-/m1/s1