[3-(3-methoxypropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-phenethylbenzoate

Systemtic Name: [3-(3-methoxypropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-phenethylbenzoate Openeye Name: [3-(3-methoxypropylcarbamoyl)-2-oxo-chromen-7-yl] 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [3-[(3-methoxypropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxypropylcarbamoyl)-2-oxochromen-7-yl] 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [2-keto-3-(3-methoxypropylcarbamoyl)chromen-7-yl] ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC=CC=C3CCC4=CC=CC=C4)OC1=O

Isomeric SMILES

COCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC=CC=C3CCC4=CC=CC=C4)OC1=O

InChI

InChI=1S/C29H27NO6/c1-34-17-7-16-30-27(31)25-18-22-14-15-23(19-26(22)36-29(25)33)35-28(32)24-11-6-5-10-21(24)13-12-20-8-3-2-4-9-20/h2-6,8-11,14-15,18-19H,7,12-13,16-17H2,1H3,(H,30,31)