1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]indole-4-carboxylic acid

Systemtic Name: 1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]indole-4-carboxylic acid Openeye Name: 1-[2-oxo-2-(sec-butylamino)ethyl]indole-4-carboxylic acid CAS Name: 1-[2-(butan-2-ylamino)-2-oxoethyl]-4-indolecarboxylic acid IUPAC Name: 1-[2-(butan-2-ylamino)-2-oxoethyl]indole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(sec-butylamino)ethyl]indole-4-carboxylic acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C=CC2=C(C=CC=C21)C(=O)O

Isomeric SMILES

CCC(C)NC(=O)CN1C=CC2=C(C=CC=C21)C(=O)O

InChI

InChI=1S/C15H18N2O3/c1-3-10(2)16-14(18)9-17-8-7-11-12(15(19)20)5-4-6-13(11)17/h4-8,10H,3,9H2,1-2H3,(H,16,18)(H,19,20)