3-azanyl-N-(7-oxidanylidene-9-pentyl-phenoxazin-3-yl)propanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-azanyl-N-(7-oxidanylidene-9-pentyl-phenoxazin-3-yl)propanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-amino-N-(7-oxo-9-pentyl-phenoxazin-3-yl)propanamide; 2,2,2-trifluoroacetic acid CAS Name: 3-amino-N-(7-oxo-9-pentyl-3-phenoxazinyl)propanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 3-amino-N-(7-oxo-9-pentylphenoxazin-3-yl)propanamide; 2,2,2-trifluoroacetic acid Traditional Name: 3-amino-N-(9-amyl-7-keto-phenoxazin-3-yl)propionamide; 2,2,2-trifluoroacetic acid Formula: C22H24F3N3O5 MolecularWeight: 467.43827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)C=C2C1=NC3=C(O2)C=C(C=C3)NC(=O)CCN.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCCCCC1=CC(=O)C=C2C1=NC3=C(O2)C=C(C=C3)NC(=O)CCN.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H23N3O3.C2HF3O2/c1-2-3-4-5-13-10-15(24)12-18-20(13)23-16-7-6-14(11-17(16)26-18)22-19(25)8-9-21;3-2(4,5)1(6)7/h6-7,10-12H,2-5,8-9,21H2,1H3,(H,22,25);(H,6,7)