N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-N-(quinolin-6-ylmethyl)-1,3-benzodioxol-5-amine

Systemtic Name: N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-N-(quinolin-6-ylmethyl)-1,3-benzodioxol-5-amine Openeye Name: N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-N-(6-quinolylmethyl)-1,3-benzodioxol-5-amine CAS Name: N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-N-(6-quinolinylmethyl)-1,3-benzodioxol-5-amine IUPAC Name: N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-N-(quinolin-6-ylmethyl)-1,3-benzodioxol-5-amine Traditional Name: 1,3-benzodioxol-5-yl-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-(6-quinolylmethyl)amine Formula: C31H30N4O2 MolecularWeight: 490.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3=CC4=C(C=C3)N=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3=CC4=C(C=C3)N=CC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C31H30N4O2/c1-2-3-16-35-27(19-33-31(35)24-8-5-4-6-9-24)21-34(26-12-14-29-30(18-26)37-22-36-29)20-23-11-13-28-25(17-23)10-7-15-32-28/h4-15,17-19H,2-3,16,20-22H2,1H3