[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxidanylidene-chromen-7-yl] 2-methylbenzoate

Systemtic Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxidanylidene-chromen-7-yl] 2-methylbenzoate Openeye Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxo-chromen-7-yl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-4-oxochromen-7-yl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-4-keto-2-methyl-chromen-7-yl] ester Formula: C29H26O6 MolecularWeight: 470.51314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OC(=O)C5=CC=CC=C5C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OC(=O)C5=CC=CC=C5C

InChI

InChI=1S/C29H26O6/c1-4-19-14-22-25(16-24(19)35-29(31)21-9-6-5-8-17(21)2)34-18(3)27(28(22)30)20-10-11-23-26(15-20)33-13-7-12-32-23/h5-6,8-11,14-16H,4,7,12-13H2,1-3H3