7,7-dimethyl-4-(3-nitrophenyl)-1-prop-2-enyl-3,4,6,8-tetrahydroquinazoline-2,5-dione

Systemtic Name: 7,7-dimethyl-4-(3-nitrophenyl)-1-prop-2-enyl-3,4,6,8-tetrahydroquinazoline-2,5-dione Openeye Name: 1-allyl-7,7-dimethyl-4-(3-nitrophenyl)-3,4,6,8-tetrahydroquinazoline-2,5-dione CAS Name: 7,7-dimethyl-4-(3-nitrophenyl)-1-prop-2-enyl-3,4,6,8-tetrahydroquinazoline-2,5-dione IUPAC Name: 7,7-dimethyl-4-(3-nitrophenyl)-1-prop-2-enyl-3,4,6,8-tetrahydroquinazoline-2,5-dione Traditional Name: 1-allyl-7,7-dimethyl-4-(3-nitrophenyl)-3,4,6,8-tetrahydroquinazoline-2,5-quinone Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC(=O)N2CC=C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC(=O)N2CC=C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C19H21N3O4/c1-4-8-21-14-10-19(2,3)11-15(23)16(14)17(20-18(21)24)12-6-5-7-13(9-12)22(25)26/h4-7,9,17H,1,8,10-11H2,2-3H3,(H,20,24)