3-(aminomethyl)-4-hexadecoxy-butanenitrile

Systemtic Name: 3-(aminomethyl)-4-hexadecoxy-butanenitrile Openeye Name: 3-(aminomethyl)-4-hexadecoxy-butanenitrile CAS Name: 3-(aminomethyl)-4-hexadecoxybutanenitrile IUPAC Name: 3-(aminomethyl)-4-hexadecoxybutanenitrile Traditional Name: 3-(aminomethyl)-4-cetyloxy-butyronitrile Formula: C21H42N2O MolecularWeight: 338.57098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CC#N)CN

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CC#N)CN

InChI

InChI=1S/C21H42N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-20-21(19-23)16-17-22/h21H,2-16,18-20,23H2,1H3