(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-phenothiazin-10-ylpropanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-phenothiazin-10-ylpropanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C23H18N4O3S MolecularWeight: 430.47902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C23H18N4O3S/c28-22(30-15-27-23(29)16-7-1-2-8-17(16)24-25-27)13-14-26-18-9-3-5-11-20(18)31-21-12-6-4-10-19(21)26/h1-12H,13-15H2