[10-methanoyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]phenothiazin-3-yl] prop-2-enoate

Systemtic Name: [10-methanoyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]phenothiazin-3-yl] prop-2-enoate Openeye Name: (7-tert-butoxycarbonyloxy-10-formyl-phenothiazin-3-yl) prop-2-enoate CAS Name: 2-propenoic acid [10-formyl-7-[(2-methylpropan-2-yl)oxy-oxomethoxy]-3-phenothiazinyl] ester IUPAC Name: [10-formyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]phenothiazin-3-yl] prop-2-enoate Traditional Name: acrylic acid (7-tert-butoxycarbonyloxy-10-formyl-phenothiazin-3-yl) ester Formula: C21H19NO6S MolecularWeight: 413.44366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)OC(=O)C=C)C=O

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)OC(=O)C=C)C=O

InChI

InChI=1S/C21H19NO6S/c1-5-19(24)26-13-6-8-15-17(10-13)29-18-11-14(7-9-16(18)22(15)12-23)27-20(25)28-21(2,3)4/h5-12H,1H2,2-4H3