5,5-dimethyl-2-(3-oxidanylpropylamino)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one

Systemtic Name: 5,5-dimethyl-2-(3-oxidanylpropylamino)-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one Openeye Name: 3-allyl-2-(3-hydroxypropylamino)-5,5-dimethyl-6H-benzo[h]quinazolin-4-one CAS Name: 2-(3-hydroxypropylamino)-5,5-dimethyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one IUPAC Name: 2-(3-hydroxypropylamino)-5,5-dimethyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one Traditional Name: 3-allyl-2-(3-hydroxypropylamino)-5,5-dimethyl-6H-benzo[h]quinazolin-4-one Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)NCCCO)CC=C)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)NCCCO)CC=C)C

InChI

InChI=1S/C20H25N3O2/c1-4-11-23-18(25)16-17(22-19(23)21-10-7-12-24)15-9-6-5-8-14(15)13-20(16,2)3/h4-6,8-9,24H,1,7,10-13H2,2-3H3,(H,21,22)