7-chloranyl-2-[[[3-(4-ethylphenoxy)-2-oxidanyl-propyl]-propyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[[3-(4-ethylphenoxy)-2-oxidanyl-propyl]-propyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[[3-(4-ethylphenoxy)-2-hydroxy-propyl]-propyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[3-(4-ethylphenoxy)-2-hydroxypropyl]-propylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[[3-(4-ethylphenoxy)-2-hydroxypropyl]-propylamino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[3-(4-ethylphenoxy)-2-hydroxy-propyl]-propyl-amino]methyl]-1H-quinazolin-4-one Formula: C23H28ClN3O3 MolecularWeight: 429.93972

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(COC3=CC=C(C=C3)CC)O

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(COC3=CC=C(C=C3)CC)O

InChI

InChI=1S/C23H28ClN3O3/c1-3-11-27(13-18(28)15-30-19-8-5-16(4-2)6-9-19)14-22-25-21-12-17(24)7-10-20(21)23(29)26-22/h5-10,12,18,28H,3-4,11,13-15H2,1-2H3,(H,25,26,29)