4,6-bis(chloranyl)-3-[(E)-2-methyl-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-[(E)-2-methyl-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[(E)-3-anilino-2-methyl-3-oxo-prop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid CAS Name: 3-[(E)-3-anilino-2-methyl-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid IUPAC Name: 3-[(E)-3-anilino-2-methyl-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid Traditional Name: 3-[(E)-3-anilino-3-keto-2-methyl-prop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid Formula: C19H14Cl2N2O3 MolecularWeight: 389.23206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C/C(=C\C1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O)/C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H14Cl2N2O3/c1-10(18(24)22-12-5-3-2-4-6-12)7-13-16-14(21)8-11(20)9-15(16)23-17(13)19(25)26/h2-9,23H,1H3,(H,22,24)(H,25,26)/b10-7+