methyl 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]naphthalene-2-carboxylate

Systemtic Name: methyl 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]naphthalene-2-carboxylate Openeye Name: methyl 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]naphthalene-2-carboxylate CAS Name: 3-[[(E)-3-(3,4-dichlorophenyl)-1-oxobut-2-enyl]amino]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]naphthalene-2-carboxylate Traditional Name: 3-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]naphthalene-2-carboxylic acid methyl ester Formula: C22H17Cl2NO3 MolecularWeight: 414.28128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC2=CC=CC=C2C=C1C(=O)OC)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C/C(=C\C(=O)NC1=CC2=CC=CC=C2C=C1C(=O)OC)/C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H17Cl2NO3/c1-13(14-7-8-18(23)19(24)11-14)9-21(26)25-20-12-16-6-4-3-5-15(16)10-17(20)22(27)28-2/h3-12H,1-2H3,(H,25,26)/b13-9+