7-[(3S)-piperidin-1-ium-3-yl]carbonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Systemtic Name: 7-[(3S)-piperidin-1-ium-3-yl]carbonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione Openeye Name: 7-[(3S)-piperidin-1-ium-3-carbonyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione CAS Name: 7-[oxo-[(3S)-3-piperidin-1-iumyl]methyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione IUPAC Name: 7-[(3S)-piperidin-1-ium-3-carbonyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione Traditional Name: 7-[(3S)-piperidin-1-ium-3-carbonyl]-1,5-dihydro-1,5-benzodiazepine-2,4-quinone Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

InChI

InChI=1S/C15H17N3O3/c19-13-7-14(20)18-12-6-9(3-4-11(12)17-13)15(21)10-2-1-5-16-8-10/h3-4,6,10,16H,1-2,5,7-8H2,(H,17,19)(H,18,20)/p+1/t10-/m0/s1