(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H24N2O5/c30-24-16-20(25-22-9-5-4-6-18(22)10-11-23(25)34-24)17-33-26(31)19-12-14-29(15-13-19)27(32)28-21-7-2-1-3-8-21/h1-11,16,19H,12-15,17H2,(H,28,32)