(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: (6-chloro-2-oxo-4-propyl-chromen-7-yl) (2S)-2-(tert-butoxycarbonylamino)pentanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-propylchromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)valeric acid (6-chloro-2-keto-4-propyl-chromen-7-yl) ester Formula: C22H28ClNO6 MolecularWeight: 437.91382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CCC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@H](CCC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28ClNO6/c1-6-8-13-10-19(25)28-17-12-18(15(23)11-14(13)17)29-20(26)16(9-7-2)24-21(27)30-22(3,4)5/h10-12,16H,6-9H2,1-5H3,(H,24,27)/t16-/m0/s1