4-(3-bromanylphenoxy)-N-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]butanamide

Systemtic Name: 4-(3-bromanylphenoxy)-N-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]butanamide Openeye Name: 4-(3-bromophenoxy)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]butanamide CAS Name: 4-(3-bromophenoxy)-N-[3-methyl-4-(1-tetrazolyl)phenyl]butanamide IUPAC Name: 4-(3-bromophenoxy)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]butanamide Traditional Name: 4-(3-bromophenoxy)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]butyramide Formula: C18H18BrN5O2 MolecularWeight: 416.27182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCCOC2=CC(=CC=C2)Br)N3C=NN=N3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCCOC2=CC(=CC=C2)Br)N3C=NN=N3

InChI

InChI=1S/C18H18BrN5O2/c1-13-10-15(7-8-17(13)24-12-20-22-23-24)21-18(25)6-3-9-26-16-5-2-4-14(19)11-16/h2,4-5,7-8,10-12H,3,6,9H2,1H3,(H,21,25)