butan-1-amine; octadecan-1-amine; phenylmethanamine

Systemtic Name: butan-1-amine; octadecan-1-amine; phenylmethanamine Openeye Name: butan-1-amine; octadecan-1-amine; phenylmethanamine CAS Name: 1-butanamine; 1-octadecanamine; phenylmethanamine IUPAC Name: butan-1-amine; octadecan-1-amine; phenylmethanamine Traditional Name: benzylamine; butylamine; stearylamine Formula: C29H59N3 MolecularWeight: 449.79886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN.CCCCN.C1=CC=C(C=C1)CN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN.CCCCN.C1=CC=C(C=C1)CN

InChI

InChI=1S/C18H39N.C7H9N.C4H11N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;8-6-7-4-2-1-3-5-7;1-2-3-4-5/h2-19H2,1H3;1-5H,6,8H2;2-5H2,1H3