4-[[3-azanylpropyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-azanylpropyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[3-aminopropyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[3-aminopropyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[3-aminopropyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[3-aminopropyl-(3-phenoxybenzyl)amino]methyl]benzonitrile Formula: C24H25N3O MolecularWeight: 371.4748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CCCN)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CCCN)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H25N3O/c25-14-5-15-27(18-21-12-10-20(17-26)11-13-21)19-22-6-4-9-24(16-22)28-23-7-2-1-3-8-23/h1-4,6-13,16H,5,14-15,18-19,25H2