4-[[4-[(4-ethoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]-methyl-amino]phenol

Systemtic Name: 4-[[4-[(4-ethoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]-methyl-amino]phenol Openeye Name: 4-[[4-(4-ethoxyanilino)-6-methyl-5-nitro-pyrimidin-2-yl]-methyl-amino]phenol CAS Name: 4-[[4-(4-ethoxyanilino)-6-methyl-5-nitro-2-pyrimidinyl]-methylamino]phenol IUPAC Name: 4-[[4-(4-ethoxyanilino)-6-methyl-5-nitropyrimidin-2-yl]-methylamino]phenol Traditional Name: 4-[methyl-[4-methyl-5-nitro-6-(p-phenetidino)pyrimidin-2-yl]amino]phenol Formula: C20H21N5O4 MolecularWeight: 395.41184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)N(C)C3=CC=C(C=C3)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)N(C)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H21N5O4/c1-4-29-17-11-5-14(6-12-17)22-19-18(25(27)28)13(2)21-20(23-19)24(3)15-7-9-16(26)10-8-15/h5-12,26H,4H2,1-3H3,(H,21,22,23)