(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4)C

InChI

InChI=1S/C25H24N2O5/c1-15-11-19-18(13-23(28)31-22(19)12-16(15)2)14-30-24(29)17-7-9-27(10-8-17)25-26-20-5-3-4-6-21(20)32-25/h3-6,11-13,17H,7-10,14H2,1-2H3