(phenylmethyl) 2-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-propyl]amino]butanoate

Systemtic Name: (phenylmethyl) 2-[[2-oxidanyl-3-(4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-propyl]amino]butanoate Openeye Name: benzyl 2-[[2-hydroxy-3-(4-oxo-2-phenyl-chromen-7-yl)oxy-propyl]amino]butanoate CAS Name: 2-[[2-hydroxy-3-[(4-oxo-2-phenyl-1-benzopyran-7-yl)oxy]propyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-hydroxy-3-(4-oxo-2-phenylchromen-7-yl)oxypropyl]amino]butanoate Traditional Name: 2-[[2-hydroxy-3-(4-keto-2-phenyl-chromen-7-yl)oxy-propyl]amino]butyric acid benzyl ester Formula: C29H29NO6 MolecularWeight: 487.54366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)NCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)NCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O

InChI

InChI=1S/C29H29NO6/c1-2-25(29(33)35-18-20-9-5-3-6-10-20)30-17-22(31)19-34-23-13-14-24-26(32)16-27(36-28(24)15-23)21-11-7-4-8-12-21/h3-16,22,25,30-31H,2,17-19H2,1H3