N-[(4-bromophenyl)methyl]-3-(2-methoxy-4-prop-2-ynoxy-phenyl)propanamide

Systemtic Name: N-[(4-bromophenyl)methyl]-3-(2-methoxy-4-prop-2-ynoxy-phenyl)propanamide Openeye Name: N-[(4-bromophenyl)methyl]-3-(2-methoxy-4-prop-2-ynoxy-phenyl)propanamide CAS Name: N-[(4-bromophenyl)methyl]-3-(2-methoxy-4-prop-2-ynoxyphenyl)propanamide IUPAC Name: N-[(4-bromophenyl)methyl]-3-(2-methoxy-4-prop-2-ynoxyphenyl)propanamide Traditional Name: N-(4-bromobenzyl)-3-(2-methoxy-4-propargyloxy-phenyl)propionamide Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC#C)CCC(=O)NCC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)OCC#C)CCC(=O)NCC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H20BrNO3/c1-3-12-25-18-10-6-16(19(13-18)24-2)7-11-20(23)22-14-15-4-8-17(21)9-5-15/h1,4-6,8-10,13H,7,11-12,14H2,2H3,(H,22,23)