(4-azanyl-5-ethoxycarbonyl-6-methyl-furo[2,3-d]pyrimidin-2-yl)methyl-(phenylmethyl)azanium

Systemtic Name: (4-azanyl-5-ethoxycarbonyl-6-methyl-furo[2,3-d]pyrimidin-2-yl)methyl-(phenylmethyl)azanium Openeye Name: (4-amino-5-ethoxycarbonyl-6-methyl-furo[2,3-d]pyrimidin-2-yl)methyl-benzyl-ammonium CAS Name: (4-amino-5-ethoxycarbonyl-6-methyl-2-furo[2,3-d]pyrimidinyl)methyl-(phenylmethyl)ammonium IUPAC Name: (4-amino-5-ethoxycarbonyl-6-methylfuro[2,3-d]pyrimidin-2-yl)methyl-benzylazanium Traditional Name: (4-amino-5-carbethoxy-6-methyl-furo[2,3-d]pyrimidin-2-yl)methyl-benzyl-ammonium Formula: C18H21N4O3+ MolecularWeight: 341.38434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)C[NH2+]CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)C[NH2+]CC3=CC=CC=C3)C

InChI

InChI=1S/C18H20N4O3/c1-3-24-18(23)14-11(2)25-17-15(14)16(19)21-13(22-17)10-20-9-12-7-5-4-6-8-12/h4-8,20H,3,9-10H2,1-2H3,(H2,19,21,22)/p+1