2-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanoylamino]hexanoic acid

Systemtic Name: 2-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanoylamino]hexanoic acid Openeye Name: 2-[2-(3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxypropanoylamino]hexanoic acid CAS Name: 2-[[2-[[4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 2-[2-(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoylamino]hexanoic acid Traditional Name: 2-[2-(3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl)oxypropanoylamino]hexanoic acid Formula: C27H31NO6 MolecularWeight: 465.53814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C(C)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C(C)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C27H31NO6/c1-5-6-12-22(26(30)31)28-25(29)18(4)33-23-14-13-20-16(2)21(15-19-10-8-7-9-11-19)27(32)34-24(20)17(23)3/h7-11,13-14,18,22H,5-6,12,15H2,1-4H3,(H,28,29)(H,30,31)