3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitro-quinazolin-4-one

Systemtic Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitro-quinazolin-4-one Openeye Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitro-quinazolin-4-one CAS Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitro-4-quinazolinone IUPAC Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitroquinazolin-4-one Traditional Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-dimethylaminophenyl)-7-nitro-quinazolin-4-one Formula: C29H31N5O5 MolecularWeight: 529.58694

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2CCN4CCC5=CC(=C(C=C5C4)OC)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2CCN4CCC5=CC(=C(C=C5C4)OC)OC

InChI

InChI=1S/C29H31N5O5/c1-31(2)22-7-5-19(6-8-22)28-30-25-17-23(34(36)37)9-10-24(25)29(35)33(28)14-13-32-12-11-20-15-26(38-3)27(39-4)16-21(20)18-32/h5-10,15-17H,11-14,18H2,1-4H3