7-[oxidanyl-(phenylmethyl)amino]tridec-5-ynenitrile

Systemtic Name: 7-[oxidanyl-(phenylmethyl)amino]tridec-5-ynenitrile Openeye Name: 7-[benzyl(hydroxy)amino]tridec-5-ynenitrile CAS Name: 7-[hydroxy-(phenylmethyl)amino]-5-tridecynenitrile IUPAC Name: 7-[benzyl(hydroxy)amino]tridec-5-ynenitrile Traditional Name: 7-[benzyl(hydroxy)amino]tridec-5-ynenitrile Formula: C20H28N2O MolecularWeight: 312.44912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C#CCCCC#N)N(CC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCC(C#CCCCC#N)N(CC1=CC=CC=C1)O

InChI

InChI=1S/C20H28N2O/c1-2-3-4-10-15-20(16-11-5-6-12-17-21)22(23)18-19-13-8-7-9-14-19/h7-9,13-14,20,23H,2-6,10,12,15,18H2,1H3