1-[4-[[3-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile

Systemtic Name: 1-[4-[[3-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile Openeye Name: 1-[4-[[3-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile CAS Name: 1-[4-[[3-(3-cyanopropoxy)phenyl]methylamino]phenyl]-2-indolecarbonitrile IUPAC Name: 1-[4-[[3-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile Traditional Name: 1-[4-[[3-(3-cyanopropoxy)benzyl]amino]phenyl]indole-2-carbonitrile Formula: C26H22N4O MolecularWeight: 406.47908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2C3=CC=C(C=C3)NCC4=CC(=CC=C4)OCCCC#N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2C3=CC=C(C=C3)NCC4=CC(=CC=C4)OCCCC#N)C#N

InChI

InChI=1S/C26H22N4O/c27-14-3-4-15-31-25-8-5-6-20(16-25)19-29-22-10-12-23(13-11-22)30-24(18-28)17-21-7-1-2-9-26(21)30/h1-2,5-13,16-17,29H,3-4,15,19H2