methyl 3-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: methyl 3-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-3-(3,4-dimethoxyphenyl)propanoate Openeye Name: methyl 3-(chromane-3-carbonylamino)-3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-[[3,4-dihydro-2H-1-benzopyran-3-yl(oxo)methyl]amino]-3-(3,4-dimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dihydro-2H-chromene-3-carbonylamino)-3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(chroman-3-carbonylamino)-3-(3,4-dimethoxyphenyl)propionic acid methyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2CC3=CC=CC=C3OC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2CC3=CC=CC=C3OC2)OC

InChI

InChI=1S/C22H25NO6/c1-26-19-9-8-14(11-20(19)27-2)17(12-21(24)28-3)23-22(25)16-10-15-6-4-5-7-18(15)29-13-16/h4-9,11,16-17H,10,12-13H2,1-3H3,(H,23,25)