2-(4-octoxyphenyl)-6-pentyl-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 2-(4-octoxyphenyl)-6-pentyl-5,6,7,8-tetrahydroquinazoline Openeye Name: 2-(4-octoxyphenyl)-6-pentyl-5,6,7,8-tetrahydroquinazoline CAS Name: 2-(4-octoxyphenyl)-6-pentyl-5,6,7,8-tetrahydroquinazoline IUPAC Name: 2-(4-octoxyphenyl)-6-pentyl-5,6,7,8-tetrahydroquinazoline Traditional Name: 6-amyl-2-(4-octoxyphenyl)-5,6,7,8-tetrahydroquinazoline Formula: C27H40N2O MolecularWeight: 408.6193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C3CC(CCC3=N2)CCCCC

InChI

InChI=1S/C27H40N2O/c1-3-5-7-8-9-11-19-30-25-16-14-23(15-17-25)27-28-21-24-20-22(12-10-6-4-2)13-18-26(24)29-27/h14-17,21-22H,3-13,18-20H2,1-2H3