2-[1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]indol-3-yl]ethanoic acid Openeye Name: 2-[1-[2-oxo-2-(sec-butylamino)ethyl]indol-3-yl]acetic acid CAS Name: 2-[1-[2-(butan-2-ylamino)-2-oxoethyl]-3-indolyl]acetic acid IUPAC Name: 2-[1-[2-(butan-2-ylamino)-2-oxoethyl]indol-3-yl]acetic acid Traditional Name: 2-[1-[2-keto-2-(sec-butylamino)ethyl]indol-3-yl]acetic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C=C(C2=CC=CC=C21)CC(=O)O

Isomeric SMILES

CCC(C)NC(=O)CN1C=C(C2=CC=CC=C21)CC(=O)O

InChI

InChI=1S/C16H20N2O3/c1-3-11(2)17-15(19)10-18-9-12(8-16(20)21)13-6-4-5-7-14(13)18/h4-7,9,11H,3,8,10H2,1-2H3,(H,17,19)(H,20,21)