5-chloranyl-3-[2-(3-ethoxypropylamino)-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-[2-(3-ethoxypropylamino)-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-(3-ethoxypropylamino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-(3-ethoxypropylamino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-(3-ethoxypropylamino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-(3-ethoxypropylamino)-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C16H19ClN2O4 MolecularWeight: 338.78606

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCOCCCNC(=O)CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H19ClN2O4/c1-2-23-7-3-6-18-14(20)9-12-11-8-10(17)4-5-13(11)19-15(12)16(21)22/h4-5,8,19H,2-3,6-7,9H2,1H3,(H,18,20)(H,21,22)