(3-azanyl-3-oxidanylidene-propyl)-[(5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl)-[(5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl]-(phenylmethyl)azanium Openeye Name: (3-amino-3-oxo-propyl)-benzyl-[(5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl]ammonium CAS Name: (3-amino-3-oxopropyl)-[(5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: (3-amino-3-oxopropyl)-benzyl-[(5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl]azanium Traditional Name: (3-amino-3-keto-propyl)-benzyl-[(5-carbethoxy-2-keto-3,4-dihydro-1H-pyrimidin-6-yl)methyl]ammonium Formula: C18H25N4O4+ MolecularWeight: 361.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)C[NH+](CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)C[NH+](CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O4/c1-2-26-17(24)14-10-20-18(25)21-15(14)12-22(9-8-16(19)23)11-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,23)(H2,20,21,25)/p+1