2-azanylethanol; 4-[[3,5-bis(chloranyl)phenyl]amino]-2-methylidene-4-oxidanylidene-butanoic acid

Systemtic Name: 2-azanylethanol; 4-[[3,5-bis(chloranyl)phenyl]amino]-2-methylidene-4-oxidanylidene-butanoic acid Openeye Name: 2-aminoethanol; 4-(3,5-dichloroanilino)-2-methylene-4-oxo-butanoic acid CAS Name: 2-aminoethanol; 4-(3,5-dichloroanilino)-2-methylene-4-oxobutanoic acid IUPAC Name: 2-aminoethanol; 4-(3,5-dichloroanilino)-2-methylidene-4-oxobutanoic acid Traditional Name: 2-aminoethanol; 2-[2-(3,5-dichloroanilino)-2-keto-ethyl]acrylic acid Formula: C13H16Cl2N2O4 MolecularWeight: 335.18314

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CC(=O)NC1=CC(=CC(=C1)Cl)Cl)C(=O)O.C(CO)N

Isomeric SMILES

C=C(CC(=O)NC1=CC(=CC(=C1)Cl)Cl)C(=O)O.C(CO)N

InChI

InChI=1S/C11H9Cl2NO3.C2H7NO/c1-6(11(16)17)2-10(15)14-9-4-7(12)3-8(13)5-9;3-1-2-4/h3-5H,1-2H2,(H,14,15)(H,16,17);4H,1-3H2