[4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] pentyl carbonate

Systemtic Name: [4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] pentyl carbonate Openeye Name: [4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] pentyl carbonate CAS Name: carbonic acid [4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] pentyl ester IUPAC Name: [4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] pentyl carbonate Traditional Name: carbonic acid amyl [4-(6-heptyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester Formula: C27H38N2O3 MolecularWeight: 438.60222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)OCCCCC

Isomeric SMILES

CCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)OCCCCC

InChI

InChI=1S/C27H38N2O3/c1-3-5-7-8-9-11-21-12-17-25-23(19-21)20-28-26(29-25)22-13-15-24(16-14-22)32-27(30)31-18-10-6-4-2/h13-16,20-21H,3-12,17-19H2,1-2H3