2-[[(2S,3S)-1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]quinazolin-4-olate

Systemtic Name: 2-[[(2S,3S)-1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]quinazolin-4-olate Openeye Name: 2-[[(1S,2S)-1-methoxycarbonyl-2-methyl-butyl]carbamoyl]quinazolin-4-olate CAS Name: 2-[[[(2S,3S)-1-methoxy-3-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-4-quinazolinolate IUPAC Name: 2-[[(2S,3S)-1-methoxy-3-methyl-1-oxopentan-2-yl]carbamoyl]quinazolin-4-olate Traditional Name: 2-[[(1S,2S)-1-carbomethoxy-2-methyl-butyl]carbamoyl]quinazolin-4-olate Formula: C16H18N3O4- MolecularWeight: 316.33182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1=NC2=CC=CC=C2C(=N1)[O-]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)C1=NC2=CC=CC=C2C(=N1)[O-]

InChI

InChI=1S/C16H19N3O4/c1-4-9(2)12(16(22)23-3)18-15(21)13-17-11-8-6-5-7-10(11)14(20)19-13/h5-9,12H,4H2,1-3H3,(H,18,21)(H,17,19,20)/p-1/t9-,12-/m0/s1