2-[2-azanyl-5-(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)-6-oxidanylidene-1,2-diazinan-1-yl]ethanoic acid

Systemtic Name: 2-[2-azanyl-5-(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)-6-oxidanylidene-1,2-diazinan-1-yl]ethanoic acid Openeye Name: 2-[2-amino-5-(1-ethoxycarbonyl-3-phenyl-propyl)-6-oxo-hexahydropyridazin-1-yl]acetic acid CAS Name: 2-[2-amino-5-(1-ethoxy-1-oxo-4-phenylbutan-2-yl)-6-oxo-1-diazinanyl]acetic acid IUPAC Name: 2-[2-amino-5-(1-ethoxy-1-oxo-4-phenylbutan-2-yl)-6-oxodiazinan-1-yl]acetic acid Traditional Name: 2-[2-amino-5-(1-carbethoxy-3-phenyl-propyl)-6-keto-hexahydropyridazin-1-yl]acetic acid Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)C2CCN(N(C2=O)CC(=O)O)N

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)C2CCN(N(C2=O)CC(=O)O)N

InChI

InChI=1S/C18H25N3O5/c1-2-26-18(25)15(9-8-13-6-4-3-5-7-13)14-10-11-21(19)20(17(14)24)12-16(22)23/h3-7,14-15H,2,8-12,19H2,1H3,(H,22,23)