N2-(1,3-benzodioxol-5-yl)-6-(5-chloranyl-2-ethoxy-phenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloranyl-2-ethoxy-phenyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-ethoxy-phenyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-ethoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-ethoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(5-chloro-2-ethoxy-phenyl)-s-triazin-2-yl]-(1,3-benzodioxol-5-yl)amine Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C18H16ClN5O3/c1-2-25-13-5-3-10(19)7-12(13)16-22-17(20)24-18(23-16)21-11-4-6-14-15(8-11)27-9-26-14/h3-8H,2,9H2,1H3,(H3,20,21,22,23,24)