phenyl 2-methyl-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate

Systemtic Name: phenyl 2-methyl-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate Openeye Name: phenyl 2-methyl-2-(3-pyridylmethylcarbamoyl)but-3-enoate CAS Name: 2-methyl-2-[oxo-(3-pyridinylmethylamino)methyl]-3-butenoic acid phenyl ester IUPAC Name: phenyl 2-methyl-2-(pyridin-3-ylmethylcarbamoyl)but-3-enoate Traditional Name: 2-methyl-2-(3-pyridylmethylcarbamoyl)but-3-enoic acid phenyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)(C(=O)NCC1=CN=CC=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C=C)(C(=O)NCC1=CN=CC=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O3/c1-3-18(2,17(22)23-15-9-5-4-6-10-15)16(21)20-13-14-8-7-11-19-12-14/h3-12H,1,13H2,2H3,(H,20,21)