N-[(4-phenylmethoxyphenyl)methyl]heptan-1-amine

Systemtic Name: N-[(4-phenylmethoxyphenyl)methyl]heptan-1-amine Openeye Name: N-[(4-benzyloxyphenyl)methyl]heptan-1-amine CAS Name: N-[(4-phenylmethoxyphenyl)methyl]-1-heptanamine IUPAC Name: N-[(4-phenylmethoxyphenyl)methyl]heptan-1-amine Traditional Name: (4-benzoxybenzyl)-heptyl-amine Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCNCC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29NO/c1-2-3-4-5-9-16-22-17-19-12-14-21(15-13-19)23-18-20-10-7-6-8-11-20/h6-8,10-15,22H,2-5,9,16-18H2,1H3