6-chloranyl-3-[2-[3-(dimethylamino)propylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 6-chloranyl-3-[2-[3-(dimethylamino)propylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 6-chloro-3-[2-[3-(dimethylamino)propylamino]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 6-chloro-3-[2-[3-(dimethylamino)propylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 6-chloro-3-[2-[3-(dimethylamino)propylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 6-chloro-3-[2-[3-(dimethylamino)propylamino]-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C16H20ClN3O3 MolecularWeight: 337.8013

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)CC1=C(NC2=C1C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

CN(C)CCCNC(=O)CC1=C(NC2=C1C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C16H20ClN3O3/c1-20(2)7-3-6-18-14(21)9-12-11-5-4-10(17)8-13(11)19-15(12)16(22)23/h4-5,8,19H,3,6-7,9H2,1-2H3,(H,18,21)(H,22,23)