ethyl 3-[2-(3-ethoxy-3-oxidanylidene-propyl)-7-[3-(4-nitrophenoxy)propoxy]-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoate

Systemtic Name: ethyl 3-[2-(3-ethoxy-3-oxidanylidene-propyl)-7-[3-(4-nitrophenoxy)propoxy]-4-oxidanylidene-8-propyl-3H-chromen-2-yl]propanoate Openeye Name: ethyl 3-[2-(3-ethoxy-3-oxo-propyl)-7-[3-(4-nitrophenoxy)propoxy]-4-oxo-8-propyl-chroman-2-yl]propanoate CAS Name: 3-[2-(3-ethoxy-3-oxopropyl)-7-[3-(4-nitrophenoxy)propoxy]-4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(3-ethoxy-3-oxopropyl)-7-[3-(4-nitrophenoxy)propoxy]-4-oxo-8-propyl-3H-chromen-2-yl]propanoate Traditional Name: 3-[2-(3-ethoxy-3-keto-propyl)-4-keto-7-[3-(4-nitrophenoxy)propoxy]-8-propyl-chroman-2-yl]propionic acid ethyl ester Formula: C31H39NO10 MolecularWeight: 585.64206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2=O)(CCC(=O)OCC)CCC(=O)OCC)OCCCOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2=O)(CCC(=O)OCC)CCC(=O)OCC)OCCCOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C31H39NO10/c1-4-8-25-27(41-20-7-19-40-23-11-9-22(10-12-23)32(36)37)14-13-24-26(33)21-31(42-30(24)25,17-15-28(34)38-5-2)18-16-29(35)39-6-3/h9-14H,4-8,15-21H2,1-3H3