3,6-bis(chloranyl)-2-methoxy-benzoic acid; N,N-bis(ethenyl)aniline

Systemtic Name: 3,6-bis(chloranyl)-2-methoxy-benzoic acid; N,N-bis(ethenyl)aniline Openeye Name: 3,6-dichloro-2-methoxy-benzoic acid; N,N-divinylaniline CAS Name: N,N-bis(ethenyl)aniline; 3,6-dichloro-2-methoxybenzoic acid IUPAC Name: N,N-bis(ethenyl)aniline; 3,6-dichloro-2-methoxybenzoic acid Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid; phenyl(divinyl)amine Formula: C26H23Cl4NO6 MolecularWeight: 587.27592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1C(=O)O)Cl)Cl.COC1=C(C=CC(=C1C(=O)O)Cl)Cl.C=CN(C=C)C1=CC=CC=C1

Isomeric SMILES

COC1=C(C=CC(=C1C(=O)O)Cl)Cl.COC1=C(C=CC(=C1C(=O)O)Cl)Cl.C=CN(C=C)C1=CC=CC=C1

InChI

InChI=1S/C10H11N.2C8H6Cl2O3/c1-3-11(4-2)10-8-6-5-7-9-10;2*1-13-7-5(10)3-2-4(9)6(7)8(11)12/h3-9H,1-2H2;2*2-3H,1H3,(H,11,12)