methyl (2S)-2-[6-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]hexanoylamino]propanoate

Systemtic Name: methyl (2S)-2-[6-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]hexanoylamino]propanoate Openeye Name: methyl (2S)-2-[6-(2,4-dioxo-1H-quinazolin-3-yl)hexanoylamino]propanoate CAS Name: (2S)-2-[[6-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxohexyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[6-(2,4-dioxo-1H-quinazolin-3-yl)hexanoylamino]propanoate Traditional Name: (2S)-2-[6-(2,4-diketo-1H-quinazolin-3-yl)hexanoylamino]propionic acid methyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=O

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=O

InChI

InChI=1S/C18H23N3O5/c1-12(17(24)26-2)19-15(22)10-4-3-7-11-21-16(23)13-8-5-6-9-14(13)20-18(21)25/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3,(H,19,22)(H,20,25)/t12-/m0/s1