N-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl]prop-2-yn-1-amine

Systemtic Name: N-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl]prop-2-yn-1-amine Openeye Name: N-[(3-bromo-5-methoxy-4-propoxy-phenyl)methyl]prop-2-yn-1-amine CAS Name: N-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]-2-propyn-1-amine IUPAC Name: N-[(3-bromo-5-methoxy-4-propoxyphenyl)methyl]prop-2-yn-1-amine Traditional Name: (3-bromo-5-methoxy-4-propoxy-benzyl)-propargyl-amine Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)CNCC#C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)CNCC#C)OC

InChI

InChI=1S/C14H18BrNO2/c1-4-6-16-10-11-8-12(15)14(18-7-5-2)13(9-11)17-3/h1,8-9,16H,5-7,10H2,2-3H3