N-cycloheptyl-3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide

Systemtic Name: N-cycloheptyl-3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide Openeye Name: N-cycloheptyl-3-oxo-2-(3-pyridylmethyl)isoindoline-1-carboxamide CAS Name: N-cycloheptyl-3-oxo-2-(3-pyridinylmethyl)-1H-isoindole-1-carboxamide IUPAC Name: N-cycloheptyl-3-oxo-2-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide Traditional Name: N-cycloheptyl-3-keto-2-(3-pyridylmethyl)isoindoline-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

InChI

InChI=1S/C22H25N3O2/c26-21(24-17-9-3-1-2-4-10-17)20-18-11-5-6-12-19(18)22(27)25(20)15-16-8-7-13-23-14-16/h5-8,11-14,17,20H,1-4,9-10,15H2,(H,24,26)