3-(2-ethoxyphenyl)-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-(2-ethoxyphenyl)-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-(2-ethoxyphenyl)-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-(2-ethoxyphenyl)-2-[1-[4-(2-ethyl-1-oxohexyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-(2-ethoxyphenyl)-2-[1-[4-(2-ethylhexanoyl)piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 2-[1-[4-(2-ethylhexanoyl)piperazino]ethyl]-3-o-phenetyl-quinazolin-4-one Formula: C30H40N4O3 MolecularWeight: 504.6636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OCC

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C(C)C2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4OCC

InChI

InChI=1S/C30H40N4O3/c1-5-8-13-23(6-2)29(35)33-20-18-32(19-21-33)22(4)28-31-25-15-10-9-14-24(25)30(36)34(28)26-16-11-12-17-27(26)37-7-3/h9-12,14-17,22-23H,5-8,13,18-21H2,1-4H3