dodecyl 4-methoxy-3-[2-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]benzoate

Systemtic Name: dodecyl 4-methoxy-3-[2-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]benzoate Openeye Name: dodecyl 4-methoxy-3-[2-(4-oxo-1H-quinazolin-2-yl)propanoylamino]benzoate CAS Name: 4-methoxy-3-[[1-oxo-2-(4-oxo-1H-quinazolin-2-yl)propyl]amino]benzoic acid dodecyl ester IUPAC Name: dodecyl 4-methoxy-3-[2-(4-oxo-1H-quinazolin-2-yl)propanoylamino]benzoate Traditional Name: 3-[2-(4-keto-1H-quinazolin-2-yl)propanoylamino]-4-methoxy-benzoic acid lauryl ester Formula: C31H41N3O5 MolecularWeight: 535.67434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)NC(=O)C(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)NC(=O)C(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C31H41N3O5/c1-4-5-6-7-8-9-10-11-12-15-20-39-31(37)23-18-19-27(38-3)26(21-23)33-29(35)22(2)28-32-25-17-14-13-16-24(25)30(36)34-28/h13-14,16-19,21-22H,4-12,15,20H2,1-3H3,(H,33,35)(H,32,34,36)