5-chloranyl-3-[2-[(2-methoxy-5-methyl-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-[2-[(2-methoxy-5-methyl-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-(2-methoxy-N,5-dimethyl-anilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-(2-methoxy-N,5-dimethylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-(2-methoxy-N,5-dimethylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-keto-2-(2-methoxy-N,5-dimethyl-anilino)ethyl]-1H-indole-2-carboxylic acid Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N(C)C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N(C)C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C20H19ClN2O4/c1-11-4-7-17(27-3)16(8-11)23(2)18(24)10-14-13-9-12(21)5-6-15(13)22-19(14)20(25)26/h4-9,22H,10H2,1-3H3,(H,25,26)