[2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: [2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] (E)-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-3-(4-propan-2-ylphenyl)-2-propenoic acid [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-3-p-cumenylacrylic acid [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C21H20BrNO5 MolecularWeight: 446.2912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)OC2=C(C=C(C=C2Br)C=C[N+](=O)[O-])OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)OC2=C(C=C(C=C2Br)/C=C/[N+](=O)[O-])OC

InChI

InChI=1S/C21H20BrNO5/c1-14(2)17-7-4-15(5-8-17)6-9-20(24)28-21-18(22)12-16(10-11-23(25)26)13-19(21)27-3/h4-14H,1-3H3/b9-6+,11-10+