3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methyl-amino]propanoic acid

Systemtic Name: 3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methyl-amino]propanoic acid Openeye Name: 3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methyl-amino]propanoic acid CAS Name: 3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methylamino]propanoic acid IUPAC Name: 3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methylamino]propanoic acid Traditional Name: 3-[[2-(diethylamino)-10H-phenoxazin-5-ium-1-yl]-methyl-amino]propionic acid Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C2=C(C=C1)[OH+]C3=CC=CC=C3N2)N(C)CCC(=O)O

Isomeric SMILES

CCN(CC)C1=C(C2=C(C=C1)[OH+]C3=CC=CC=C3N2)N(C)CCC(=O)O

InChI

InChI=1S/C20H25N3O3/c1-4-23(5-2)15-10-11-17-19(20(15)22(3)13-12-18(24)25)21-14-8-6-7-9-16(14)26-17/h6-11,21H,4-5,12-13H2,1-3H3,(H,24,25)/p+1