2-hydroxyethyl-methyl-[2-[(13-oxidanyl-8-oxidanylidene-naphtho[2,3-a]phenoxazin-14-ium-7-yl)amino]ethyl]azanium

Systemtic Name: 2-hydroxyethyl-methyl-[2-[(13-oxidanyl-8-oxidanylidene-naphtho[2,3-a]phenoxazin-14-ium-7-yl)amino]ethyl]azanium Openeye Name: 2-hydroxyethyl-[2-[(13-hydroxy-8-oxo-naphtho[2,3-a]phenoxazin-14-ium-7-yl)amino]ethyl]-methyl-ammonium CAS Name: 2-hydroxyethyl-[2-[(13-hydroxy-8-oxo-7-naphtho[2,3-a]phenoxazin-14-iumyl)amino]ethyl]-methylammonium IUPAC Name: 2-hydroxyethyl-[2-[(13-hydroxy-8-oxonaphtho[2,3-a]phenoxazin-14-ium-7-yl)amino]ethyl]-methylazanium Traditional Name: 2-hydroxyethyl-[2-[(13-hydroxy-8-keto-naphtho[2,3-a]phenoxazin-14-ium-7-yl)amino]ethyl]-methyl-ammonium Formula: C25H25N3O4+2 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCNC1=C2C(=C(C3=CC=CC=C3C2=O)O)C4=[NH+]C5=CC=CC=C5OC4=C1)CCO

Isomeric SMILES

C[NH+](CCNC1=C2C(=C(C3=CC=CC=C3C2=O)O)C4=[NH+]C5=CC=CC=C5OC4=C1)CCO

InChI

InChI=1S/C25H23N3O4/c1-28(12-13-29)11-10-26-18-14-20-23(27-17-8-4-5-9-19(17)32-20)22-21(18)24(30)15-6-2-3-7-16(15)25(22)31/h2-9,14,26,29,31H,10-13H2,1H3/p+2