(E)-3-[1-[(4-methoxyphenyl)methyl]-4-phenethyl-pyrrol-2-yl]-1-(2H-1,2,3,4-tetrazol-5-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[1-[(4-methoxyphenyl)methyl]-4-phenethyl-pyrrol-2-yl]-1-(2H-1,2,3,4-tetrazol-5-yl)prop-2-en-1-one Openeye Name: (E)-3-[1-[(4-methoxyphenyl)methyl]-4-phenethyl-pyrrol-2-yl]-1-(2H-tetrazol-5-yl)prop-2-en-1-one CAS Name: (E)-3-[1-[(4-methoxyphenyl)methyl]-4-phenethyl-2-pyrrolyl]-1-(2H-tetrazol-5-yl)-2-propen-1-one IUPAC Name: (E)-3-[1-[(4-methoxyphenyl)methyl]-4-phenethylpyrrol-2-yl]-1-(2H-tetrazol-5-yl)prop-2-en-1-one Traditional Name: (E)-3-(1-p-anisyl-4-phenethyl-pyrrol-2-yl)-1-(2H-tetrazol-5-yl)prop-2-en-1-one Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=C(C=C2C=CC(=O)C3=NNN=N3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=C(C=C2/C=C/C(=O)C3=NNN=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H23N5O2/c1-31-22-12-9-19(10-13-22)16-29-17-20(8-7-18-5-3-2-4-6-18)15-21(29)11-14-23(30)24-25-27-28-26-24/h2-6,9-15,17H,7-8,16H2,1H3,(H,25,26,27,28)/b14-11+