[2-[(isoquinolin-1-ylamino)methyl]piperidin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [2-[(isoquinolin-1-ylamino)methyl]piperidin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [2-[(1-isoquinolylamino)methyl]-1-piperidyl]-(1-naphthyl)methanone CAS Name: [2-[(1-isoquinolinylamino)methyl]-1-piperidinyl]-(1-naphthalenyl)methanone IUPAC Name: [2-[(isoquinolin-1-ylamino)methyl]piperidin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [2-[(1-isoquinolylamino)methyl]piperidino]-(1-naphthyl)methanone Formula: C26H25N3O MolecularWeight: 395.4962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CNC2=NC=CC3=CC=CC=C32)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCN(C(C1)CNC2=NC=CC3=CC=CC=C32)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H25N3O/c30-26(24-14-7-10-19-8-1-3-12-22(19)24)29-17-6-5-11-21(29)18-28-25-23-13-4-2-9-20(23)15-16-27-25/h1-4,7-10,12-16,21H,5-6,11,17-18H2,(H,27,28)