2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-6-methoxy-1H-quinazolin-4-one

Systemtic Name: 2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-6-methoxy-1H-quinazolin-4-one Openeye Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-6-methoxy-1H-quinazolin-4-one CAS Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-6-methoxy-1H-quinazolin-4-one IUPAC Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-6-methoxy-1H-quinazolin-4-one Traditional Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-6-methoxy-1H-quinazolin-4-one Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)OC)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=CC(=C3)OC)O

InChI

InChI=1S/C22H27N3O4/c1-22(2,3)23-12-15(26)13-29-16-7-5-14(6-8-16)20-24-19-10-9-17(28-4)11-18(19)21(27)25-20/h5-11,15,23,26H,12-13H2,1-4H3,(H,24,25,27)