N-[(6-methoxyquinolin-4-yl)methyl]-1-(3-phenylpropyl)azepan-4-amine

Systemtic Name: N-[(6-methoxyquinolin-4-yl)methyl]-1-(3-phenylpropyl)azepan-4-amine Openeye Name: N-[(6-methoxy-4-quinolyl)methyl]-1-(3-phenylpropyl)azepan-4-amine CAS Name: N-[(6-methoxy-4-quinolinyl)methyl]-1-(3-phenylpropyl)-4-azepanamine IUPAC Name: N-[(6-methoxyquinolin-4-yl)methyl]-1-(3-phenylpropyl)azepan-4-amine Traditional Name: (6-methoxy-4-quinolyl)methyl-[1-(3-phenylpropyl)azepan-4-yl]amine Formula: C26H33N3O MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)CNC3CCCN(CC3)CCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)CNC3CCCN(CC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O/c1-30-24-11-12-26-25(19-24)22(13-15-27-26)20-28-23-10-6-17-29(18-14-23)16-5-9-21-7-3-2-4-8-21/h2-4,7-8,11-13,15,19,23,28H,5-6,9-10,14,16-18,20H2,1H3