dimethyl 5-[[(3S)-3,4-dihydro-2H-chromen-3-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(3S)-3,4-dihydro-2H-chromen-3-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(3S)-chromane-3-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[(3S)-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(3S)-3,4-dihydro-2H-chromene-3-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(3S)-chroman-3-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19NO6 MolecularWeight: 369.36796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)[C@H]2CC3=CC=CC=C3OC2)C(=O)OC

InChI

InChI=1S/C20H19NO6/c1-25-19(23)13-8-14(20(24)26-2)10-16(9-13)21-18(22)15-7-12-5-3-4-6-17(12)27-11-15/h3-6,8-10,15H,7,11H2,1-2H3,(H,21,22)/t15-/m0/s1