2-[[(3R)-2-oxidanylideneazepan-3-yl]carbamoyl]quinazolin-4-olate

Systemtic Name: 2-[[(3R)-2-oxidanylideneazepan-3-yl]carbamoyl]quinazolin-4-olate Openeye Name: 2-[[(3R)-2-oxoazepan-3-yl]carbamoyl]quinazolin-4-olate CAS Name: 2-[oxo-[[(3R)-2-oxo-3-azepanyl]amino]methyl]-4-quinazolinolate IUPAC Name: 2-[[(3R)-2-oxoazepan-3-yl]carbamoyl]quinazolin-4-olate Traditional Name: 2-[[(3R)-2-ketoazepan-3-yl]carbamoyl]quinazolin-4-olate Formula: C15H15N4O3- MolecularWeight: 299.3046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)NC(=O)C2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C15H16N4O3/c20-13-9-5-1-2-6-10(9)17-12(19-13)15(22)18-11-7-3-4-8-16-14(11)21/h1-2,5-6,11H,3-4,7-8H2,(H,16,21)(H,18,22)(H,17,19,20)/p-1/t11-/m1/s1