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[4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] octanoate

[4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] octanoate

Systemtic Name:[4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] octanoate
Openeye Name:[4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] octanoate
CAS Name:octanoic acid [4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester
IUPAC Name:[4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] octanoate
Traditional Name:caprylic acid [4-(6-nonyl-5,6,7,8-tetrahydroquinazolin-2-yl)phenyl] ester
Formula: C31H46N2O2
MolecularWeight: 478.70914
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)CCCCCCC


Isomeric SMILES

CCCCCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)OC(=O)CCCCCCC


InChI

InChI=1S/C31H46N2O2/c1-3-5-7-9-10-12-13-15-25-17-22-29-27(23-25)24-32-31(33-29)26-18-20-28(21-19-26)35-30(34)16-14-11-8-6-4-2/h18-21,24-25H,3-17,22-23H2,1-2H3


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