4-[[4-[(3-methoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]amino]phenol

Systemtic Name: 4-[[4-[(3-methoxyphenyl)amino]-6-methyl-5-nitro-pyrimidin-2-yl]amino]phenol Openeye Name: 4-[[4-(3-methoxyanilino)-6-methyl-5-nitro-pyrimidin-2-yl]amino]phenol CAS Name: 4-[[4-(3-methoxyanilino)-6-methyl-5-nitro-2-pyrimidinyl]amino]phenol IUPAC Name: 4-[[4-(3-methoxyanilino)-6-methyl-5-nitropyrimidin-2-yl]amino]phenol Traditional Name: 4-[[4-(m-anisidino)-6-methyl-5-nitro-pyrimidin-2-yl]amino]phenol Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC2=CC=C(C=C2)O)NC3=CC(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NC2=CC=C(C=C2)O)NC3=CC(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4/c1-11-16(23(25)26)17(20-13-4-3-5-15(10-13)27-2)22-18(19-11)21-12-6-8-14(24)9-7-12/h3-10,24H,1-2H3,(H2,19,20,21,22)