4-butyl-1-imidazol-1-yl-isoquinoline

Systemtic Name: 4-butyl-1-imidazol-1-yl-isoquinoline Openeye Name: 4-butyl-1-imidazol-1-yl-isoquinoline CAS Name: 4-butyl-1-(1-imidazolyl)isoquinoline IUPAC Name: 4-butyl-1-imidazol-1-ylisoquinoline Traditional Name: 4-butyl-1-imidazol-1-yl-isoquinoline Formula: C16H17N3 MolecularWeight: 251.32628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C2=CC=CC=C21)N3C=CN=C3

Isomeric SMILES

CCCCC1=CN=C(C2=CC=CC=C21)N3C=CN=C3

InChI

InChI=1S/C16H17N3/c1-2-3-6-13-11-18-16(19-10-9-17-12-19)15-8-5-4-7-14(13)15/h4-5,7-12H,2-3,6H2,1H3