2,6,7-trimethyl-1-oxidanylidene-4-phenyl-N-(pyridin-2-ylmethyl)isoquinoline-3-carboxamide

Systemtic Name: 2,6,7-trimethyl-1-oxidanylidene-4-phenyl-N-(pyridin-2-ylmethyl)isoquinoline-3-carboxamide Openeye Name: 2,6,7-trimethyl-1-oxo-4-phenyl-N-(2-pyridylmethyl)isoquinoline-3-carboxamide CAS Name: 2,6,7-trimethyl-1-oxo-4-phenyl-N-(2-pyridinylmethyl)-3-isoquinolinecarboxamide IUPAC Name: 2,6,7-trimethyl-1-oxo-4-phenyl-N-(pyridin-2-ylmethyl)isoquinoline-3-carboxamide Traditional Name: 1-keto-2,6,7-trimethyl-4-phenyl-N-(2-pyridylmethyl)isoquinoline-3-carboxamide Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCC3=CC=CC=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCC3=CC=CC=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O2/c1-16-13-20-21(14-17(16)2)25(30)28(3)23(22(20)18-9-5-4-6-10-18)24(29)27-15-19-11-7-8-12-26-19/h4-14H,15H2,1-3H3,(H,27,29)