methyl (E)-3-[4-[(8-nitro-4-oxidanylidene-1H-quinazolin-5-yl)amino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[(8-nitro-4-oxidanylidene-1H-quinazolin-5-yl)amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[(8-nitro-4-oxo-1H-quinazolin-5-yl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(8-nitro-4-oxo-1H-quinazolin-5-yl)amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[(8-nitro-4-oxo-1H-quinazolin-5-yl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(4-keto-8-nitro-1H-quinazolin-5-yl)amino]phenyl]acrylic acid methyl ester Formula: C18H14N4O5 MolecularWeight: 366.32756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)[N+](=O)[O-])NC=NC3=O

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)NC2=C3C(=C(C=C2)[N+](=O)[O-])NC=NC3=O

InChI

InChI=1S/C18H14N4O5/c1-27-15(23)9-4-11-2-5-12(6-3-11)21-13-7-8-14(22(25)26)17-16(13)18(24)20-10-19-17/h2-10,21H,1H3,(H,19,20,24)/b9-4+