N-[[3-(4-methoxyphenyl)-4-prop-2-ynoxy-phenyl]methyl]-1-phenyl-ethanamine

Systemtic Name: N-[[3-(4-methoxyphenyl)-4-prop-2-ynoxy-phenyl]methyl]-1-phenyl-ethanamine Openeye Name: N-[[3-(4-methoxyphenyl)-4-prop-2-ynoxy-phenyl]methyl]-1-phenyl-ethanamine CAS Name: N-[[3-(4-methoxyphenyl)-4-prop-2-ynoxyphenyl]methyl]-1-phenylethanamine IUPAC Name: N-[[3-(4-methoxyphenyl)-4-prop-2-ynoxyphenyl]methyl]-1-phenylethanamine Traditional Name: [3-(4-methoxyphenyl)-4-propargyloxy-benzyl]-(1-phenylethyl)amine Formula: C25H25NO2 MolecularWeight: 371.4715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2=CC(=C(C=C2)OCC#C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2=CC(=C(C=C2)OCC#C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H25NO2/c1-4-16-28-25-15-10-20(18-26-19(2)21-8-6-5-7-9-21)17-24(25)22-11-13-23(27-3)14-12-22/h1,5-15,17,19,26H,16,18H2,2-3H3