2-azanyl-3-[4-oxidanyl-2-oxidanylidene-5-(2-phenylcyclopropyl)imino-cyclohex-3-en-1-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-oxidanyl-2-oxidanylidene-5-(2-phenylcyclopropyl)imino-cyclohex-3-en-1-yl]propanoic acid Openeye Name: 2-amino-3-[4-hydroxy-2-oxo-5-(2-phenylcyclopropyl)imino-cyclohex-3-en-1-yl]propanoic acid CAS Name: 2-amino-3-[4-hydroxy-2-oxo-5-(2-phenylcyclopropyl)imino-1-cyclohex-3-enyl]propanoic acid IUPAC Name: 2-amino-3-[4-hydroxy-2-oxo-5-(2-phenylcyclopropyl)iminocyclohex-3-en-1-yl]propanoic acid Traditional Name: 2-amino-3-[4-hydroxy-2-keto-5-(2-phenylcyclopropyl)imino-cyclohex-3-en-1-yl]propionic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1N=C2CC(C(=O)C=C2O)CC(C(=O)O)N)C3=CC=CC=C3

Isomeric SMILES

C1C(C1N=C2CC(C(=O)C=C2O)CC(C(=O)O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,9,11-14,22H,6-8,19H2,(H,23,24)