1-hexadecoxy-4-phenylmethoxy-butan-2-amine

Systemtic Name: 1-hexadecoxy-4-phenylmethoxy-butan-2-amine Openeye Name: 4-benzyloxy-1-hexadecoxy-butan-2-amine CAS Name: 1-hexadecoxy-4-phenylmethoxy-2-butanamine IUPAC Name: 1-hexadecoxy-4-phenylmethoxybutan-2-amine Traditional Name: [3-benzoxy-1-(cetyloxymethyl)propyl]amine Formula: C27H49NO2 MolecularWeight: 419.68346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CCOCC1=CC=CC=C1)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CCOCC1=CC=CC=C1)N

InChI

InChI=1S/C27H49NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-22-29-25-27(28)21-23-30-24-26-19-16-15-17-20-26/h15-17,19-20,27H,2-14,18,21-25,28H2,1H3