5,6-bis(oxidanylidene)-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid

Systemtic Name: 5,6-bis(oxidanylidene)-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid Openeye Name: 5,6-dioxo-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid CAS Name: 5,6-dioxo-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid IUPAC Name: 5,6-dioxo-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid Traditional Name: 5,6-diketo-11a,12-dihydro-7aH-benzo[a]phenoxazine-10-sulfonic acid Formula: C16H11NO6S MolecularWeight: 345.32664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C(=O)C2=O)OC4C=CC(=CC4N3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C(=O)C2=O)OC4C=CC(=CC4N3)S(=O)(=O)O

InChI

InChI=1S/C16H11NO6S/c18-14-10-4-2-1-3-9(10)13-16(15(14)19)23-12-6-5-8(24(20,21)22)7-11(12)17-13/h1-7,11-12,17H,(H,20,21,22)