3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile

Systemtic Name: 3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile Openeye Name: 3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile CAS Name: 3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile IUPAC Name: 3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile Traditional Name: 3-[4-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]-3H-indole-5-carbonitrile Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCN(C2)C3CCC(CC3)C4C=NC5=C4C=C(C=C5)C#N

Isomeric SMILES

COC1=CC=CC2=C1CCN(C2)C3CCC(CC3)C4C=NC5=C4C=C(C=C5)C#N

InChI

InChI=1S/C25H27N3O/c1-29-25-4-2-3-19-16-28(12-11-21(19)25)20-8-6-18(7-9-20)23-15-27-24-10-5-17(14-26)13-22(23)24/h2-5,10,13,15,18,20,23H,6-9,11-12,16H2,1H3