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

Systemtic Name: 1-[4-[[4-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile Openeye Name: 1-[4-[[4-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile CAS Name: 1-[4-[[4-(3-cyanopropoxy)phenyl]methylamino]phenyl]-2-indolecarbonitrile IUPAC Name: 1-[4-[[4-(3-cyanopropoxy)phenyl]methylamino]phenyl]indole-2-carbonitrile Traditional Name: 1-[4-[[4-(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=C(C=C4)OCCCC#N)C#N

Isomeric SMILES

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

InChI

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