5-(imidazol-1-ylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride

Systemtic Name: 5-(imidazol-1-ylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride Openeye Name: 5-(imidazol-1-ylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride CAS Name: 5-(1-imidazolylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride IUPAC Name: 5-(imidazol-1-ylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride Traditional Name: 5-(imidazol-1-ylmethyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1-carbonitrile hydrochloride Formula: C18H20ClN3 MolecularWeight: 313.8245

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC3=C2C(=C(C=C3)C#N)C1)CN4C=CN=C4.Cl

Isomeric SMILES

C1CC2CC(CC3=C2C(=C(C=C3)C#N)C1)CN4C=CN=C4.Cl

InChI

InChI=1S/C18H19N3.ClH/c19-10-16-5-4-15-9-13(11-21-7-6-20-12-21)8-14-2-1-3-17(16)18(14)15;/h4-7,12-14H,1-3,8-9,11H2;1H