4-[[2-azanylethyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-azanylethyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[2-aminoethyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[2-aminoethyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[2-aminoethyl-[(3-phenoxyphenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[2-aminoethyl-(3-phenoxybenzyl)amino]methyl]benzonitrile Formula: C23H23N3O MolecularWeight: 357.44822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O/c24-13-14-26(17-20-11-9-19(16-25)10-12-20)18-21-5-4-8-23(15-21)27-22-6-2-1-3-7-22/h1-12,15H,13-14,17-18,24H2