3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(4-nitrophenyl)carbonyl-piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(4-nitrophenyl)carbonyl-piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(4-nitrobenzoyl)piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-(2-methoxyphenyl)-2-[1-[3-methyl-4-(4-nitrobenzoyl)piperazino]ethyl]quinazolin-4-one Formula: C29H29N5O5 MolecularWeight: 527.57106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

InChI

InChI=1S/C29H29N5O5/c1-19-18-31(16-17-32(19)28(35)21-12-14-22(15-13-21)34(37)38)20(2)27-30-24-9-5-4-8-23(24)29(36)33(27)25-10-6-7-11-26(25)39-3/h4-15,19-20H,16-18H2,1-3H3