[2-[[3-methoxy-4-(propanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[3-methoxy-4-(propanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[3-methoxy-4-(propanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[3-methoxy-4-(1-oxopropylamino)anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[3-methoxy-4-(propanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-(3-methoxy-4-propionamido-anilino)ethyl]ammonium Formula: C12H18N3O3+ MolecularWeight: 252.28962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)NC(=O)C[NH3+])OC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)NC(=O)C[NH3+])OC

InChI

InChI=1S/C12H17N3O3/c1-3-11(16)15-9-5-4-8(6-10(9)18-2)14-12(17)7-13/h4-6H,3,7,13H2,1-2H3,(H,14,17)(H,15,16)/p+1