6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline Openeye Name: 6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline CAS Name: 6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline IUPAC Name: 6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline Traditional Name: 6-butyl-2-(4-heptoxyphenyl)-5,6,7,8-tetrahydroquinazoline Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCC

InChI

InChI=1S/C25H36N2O/c1-3-5-7-8-9-17-28-23-14-12-21(13-15-23)25-26-19-22-18-20(10-6-4-2)11-16-24(22)27-25/h12-15,19-20H,3-11,16-18H2,1-2H3