6-methoxy-1-oxidanylidene-4-phenyl-2-[2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]isoquinoline-3-carbonitrile

Systemtic Name: 6-methoxy-1-oxidanylidene-4-phenyl-2-[2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]isoquinoline-3-carbonitrile Openeye Name: 6-methoxy-1-oxo-4-phenyl-2-[2-(tetralin-5-ylamino)ethyl]isoquinoline-3-carbonitrile CAS Name: 6-methoxy-1-oxo-4-phenyl-2-[2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]-3-isoquinolinecarbonitrile IUPAC Name: 6-methoxy-1-oxo-4-phenyl-2-[2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]isoquinoline-3-carbonitrile Traditional Name: 1-keto-6-methoxy-4-phenyl-2-[2-(tetralin-5-ylamino)ethyl]isoquinoline-3-carbonitrile Formula: C29H27N3O2 MolecularWeight: 449.54358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C#N)CCNC4=CC=CC5=C4CCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)C#N)CCNC4=CC=CC5=C4CCCC5

InChI

InChI=1S/C29H27N3O2/c1-34-22-14-15-24-25(18-22)28(21-9-3-2-4-10-21)27(19-30)32(29(24)33)17-16-31-26-13-7-11-20-8-5-6-12-23(20)26/h2-4,7,9-11,13-15,18,31H,5-6,8,12,16-17H2,1H3