2-propan-2-yl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate

Systemtic Name: 2-propan-2-yl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Openeye Name: 2-isopropyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate CAS Name: 2-propan-2-yl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate IUPAC Name: 2-propan-2-yl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Traditional Name: 2-isopropyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium-10-carboxylate Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)[O-]

Isomeric SMILES

CC(C)[NH+]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)[O-]

InChI

InChI=1S/C16H18N2O2/c1-10(2)18-8-7-14-12(9-18)15(16(19)20)11-5-3-4-6-13(11)17-14/h3-6,10H,7-9H2,1-2H3,(H,19,20)