4-(2-azanyl-2-oxidanylidene-ethoxy)-3-[(3,4-dichlorophenyl)methyl]-5-methoxy-1H-indole-2-carboxylic acid

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-[(3,4-dichlorophenyl)methyl]-5-methoxy-1H-indole-2-carboxylic acid Openeye Name: 4-(2-amino-2-oxo-ethoxy)-3-[(3,4-dichlorophenyl)methyl]-5-methoxy-1H-indole-2-carboxylic acid CAS Name: 4-(2-amino-2-oxoethoxy)-3-[(3,4-dichlorophenyl)methyl]-5-methoxy-1H-indole-2-carboxylic acid IUPAC Name: 4-(2-amino-2-oxoethoxy)-3-[(3,4-dichlorophenyl)methyl]-5-methoxy-1H-indole-2-carboxylic acid Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-(3,4-dichlorobenzyl)-5-methoxy-1H-indole-2-carboxylic acid Formula: C19H16Cl2N2O5 MolecularWeight: 423.24674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)NC(=C2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)OCC(=O)N

Isomeric SMILES

COC1=C(C2=C(C=C1)NC(=C2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)OCC(=O)N

InChI

InChI=1S/C19H16Cl2N2O5/c1-27-14-5-4-13-16(18(14)28-8-15(22)24)10(17(23-13)19(25)26)6-9-2-3-11(20)12(21)7-9/h2-5,7,23H,6,8H2,1H3,(H2,22,24)(H,25,26)