N-[3,7-dimethoxy-10-methyl-6-[(3-oxidanylidene-1H-isoindol-2-yl)carbonyl]phenoxazin-4-yl]ethanenitrilium

Systemtic Name: N-[3,7-dimethoxy-10-methyl-6-[(3-oxidanylidene-1H-isoindol-2-yl)carbonyl]phenoxazin-4-yl]ethanenitrilium Openeye Name: N-[3,7-dimethoxy-10-methyl-6-(1-oxoisoindoline-2-carbonyl)phenoxazin-4-yl]acetonitrilium CAS Name: N-[3,7-dimethoxy-10-methyl-6-[oxo-(3-oxo-1H-isoindol-2-yl)methyl]-4-phenoxazinyl]acetonitrilium IUPAC Name: N-[3,7-dimethoxy-10-methyl-6-(3-oxo-1H-isoindole-2-carbonyl)phenoxazin-4-yl]acetonitrilium Traditional Name: N-[6-(1-ketoisoindoline-2-carbonyl)-3,7-dimethoxy-10-methyl-phenoxazin-4-yl]acetonitrilium Formula: C26H22N3O5+ MolecularWeight: 456.46998

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Descriptors Computed from Structure

Canonical SMILES:

CC#[N+]C1=C(C=CC2=C1OC3=C(N2C)C=CC(=C3C(=O)N4CC5=CC=CC=C5C4=O)OC)OC

Isomeric SMILES

CC#[N+]C1=C(C=CC2=C1OC3=C(N2C)C=CC(=C3C(=O)N4CC5=CC=CC=C5C4=O)OC)OC

InChI

InChI=1S/C26H22N3O5/c1-5-27-22-20(33-4)13-11-18-24(22)34-23-17(28(18)2)10-12-19(32-3)21(23)26(31)29-14-15-8-6-7-9-16(15)25(29)30/h6-13H,14H2,1-4H3/q+1