(4-propan-2-ylphenyl)methyl (Z)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-prop-2-enoate

Systemtic Name: (4-propan-2-ylphenyl)methyl (Z)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-prop-2-enoate Openeye Name: (4-isopropylphenyl)methyl (Z)-2-(5-methyltetrazol-1-yl)-3-phenyl-prop-2-enoate CAS Name: (Z)-2-(5-methyl-1-tetrazolyl)-3-phenyl-2-propenoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl (Z)-2-(5-methyltetrazol-1-yl)-3-phenylprop-2-enoate Traditional Name: (Z)-2-(5-methyltetrazol-1-yl)-3-phenyl-acrylic acid (4-isopropylbenzyl) ester Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=NN1C(=CC2=CC=CC=C2)C(=O)OCC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=NN=NN1/C(=C\C2=CC=CC=C2)/C(=O)OCC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H22N4O2/c1-15(2)19-11-9-18(10-12-19)14-27-21(26)20(25-16(3)22-23-24-25)13-17-7-5-4-6-8-17/h4-13,15H,14H2,1-3H3/b20-13-