1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(2-hydroxyphenyl)-5-oxidanyl-indole-3-carbonitrile

Systemtic Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(2-hydroxyphenyl)-5-oxidanyl-indole-3-carbonitrile Openeye Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-5-hydroxy-2-(2-hydroxyphenyl)indole-3-carbonitrile CAS Name: 1-[[4-[2-(1-azepanyl)ethoxy]phenyl]methyl]-5-hydroxy-2-(2-hydroxyphenyl)-3-indolecarbonitrile IUPAC Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-5-hydroxy-2-(2-hydroxyphenyl)indole-3-carbonitrile Traditional Name: 1-[4-[2-(azepan-1-yl)ethoxy]benzyl]-5-hydroxy-2-(2-hydroxyphenyl)indole-3-carbonitrile Formula: C30H31N3O3 MolecularWeight: 481.58544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)O)C(=C3C5=CC=CC=C5O)C#N

Isomeric SMILES

C1CCCN(CC1)CCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)O)C(=C3C5=CC=CC=C5O)C#N

InChI

InChI=1S/C30H31N3O3/c31-20-27-26-19-23(34)11-14-28(26)33(30(27)25-7-3-4-8-29(25)35)21-22-9-12-24(13-10-22)36-18-17-32-15-5-1-2-6-16-32/h3-4,7-14,19,34-35H,1-2,5-6,15-18,21H2