[3-[1,1-bis(chloranyl)prop-1-en-2-yl]-4-methyl-phenyl] 4-nitrobenzoate

Systemtic Name: [3-[1,1-bis(chloranyl)prop-1-en-2-yl]-4-methyl-phenyl] 4-nitrobenzoate Openeye Name: [3-(2,2-dichloro-1-methyl-vinyl)-4-methyl-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-(1,1-dichloroprop-1-en-2-yl)-4-methylphenyl] ester IUPAC Name: [3-(1,1-dichloroprop-1-en-2-yl)-4-methylphenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-(2,2-dichloro-1-methyl-vinyl)-4-methyl-phenyl] ester Formula: C17H13Cl2NO4 MolecularWeight: 366.19542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=C(Cl)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=C(Cl)Cl)C

InChI

InChI=1S/C17H13Cl2NO4/c1-10-3-8-14(9-15(10)11(2)16(18)19)24-17(21)12-4-6-13(7-5-12)20(22)23/h3-9H,1-2H3