2-(2-methylpropanoylamino)ethyl-[(2-oxidanylidene-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: 2-(2-methylpropanoylamino)ethyl-[(2-oxidanylidene-1H-quinolin-3-yl)methyl]azanium Openeye Name: 2-(2-methylpropanoylamino)ethyl-[(2-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: 2-[(2-methyl-1-oxopropyl)amino]ethyl-[(2-oxo-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: 2-(2-methylpropanoylamino)ethyl-[(2-oxo-1H-quinolin-3-yl)methyl]azanium Traditional Name: 2-(isobutyrylamino)ethyl-[(2-keto-1H-quinolin-3-yl)methyl]ammonium Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC[NH2+]CC1=CC2=CC=CC=C2NC1=O

Isomeric SMILES

CC(C)C(=O)NCC[NH2+]CC1=CC2=CC=CC=C2NC1=O

InChI

InChI=1S/C16H21N3O2/c1-11(2)15(20)18-8-7-17-10-13-9-12-5-3-4-6-14(12)19-16(13)21/h3-6,9,11,17H,7-8,10H2,1-2H3,(H,18,20)(H,19,21)/p+1