5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid Openeye Name: 5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid CAS Name: 5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid Traditional Name: 5-[3-(diethylamino)prop-1-ynyl]-1H-indole-2-carboxylic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CC1=CC2=C(C=C1)NC(=C2)C(=O)O

Isomeric SMILES

CCN(CC)CC#CC1=CC2=C(C=C1)NC(=C2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-3-18(4-2)9-5-6-12-7-8-14-13(10-12)11-15(17-14)16(19)20/h7-8,10-11,17H,3-4,9H2,1-2H3,(H,19,20)