2-[2-(cyclohepta-1,3,5-trien-1-ylamino)ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[2-(cyclohepta-1,3,5-trien-1-ylamino)ethyl]-1H-quinazolin-4-one Openeye Name: 2-[2-(cyclohepta-1,3,5-trien-1-ylamino)ethyl]-1H-quinazolin-4-one CAS Name: 2-[2-(1-cyclohepta-1,3,5-trienylamino)ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[2-(cyclohepta-1,3,5-trien-1-ylamino)ethyl]-1H-quinazolin-4-one Traditional Name: 2-[2-(cyclohepta-1,3,5-trien-1-ylamino)ethyl]-1H-quinazolin-4-one Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=CC=C1NCCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C1C=CC=CC=C1NCCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O/c21-17-14-9-5-6-10-15(14)19-16(20-17)11-12-18-13-7-3-1-2-4-8-13/h1-7,9-10,18H,8,11-12H2,(H,19,20,21)