3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]propanamide

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]propanamide Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]propanamide CAS Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(1-cyclopropyl-5-tetrazolyl)phenyl]propanamide IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]propanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]propionamide Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4)Br

InChI

InChI=1S/C20H20BrN5O2/c1-28-18-10-2-13(12-17(18)21)3-11-19(27)22-15-6-4-14(5-7-15)20-23-24-25-26(20)16-8-9-16/h2,4-7,10,12,16H,3,8-9,11H2,1H3,(H,22,27)