6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline Openeye Name: 6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline CAS Name: 6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline IUPAC Name: 6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline Traditional Name: 6-heptyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O2/c1-2-3-4-5-6-7-16-8-13-20-18(14-16)15-22-21(23-20)17-9-11-19(12-10-17)24(25)26/h9-12,15-16H,2-8,13-14H2,1H3