2-chloranyl-5-[(2E)-2-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazinyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(2E)-2-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazinyl]benzoic acid Openeye Name: 2-chloro-5-[(2E)-2-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazino]benzoic acid CAS Name: 2-chloro-5-[(2E)-2-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazinyl]benzoic acid IUPAC Name: 2-chloro-5-[(2E)-2-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazinyl]benzoic acid Traditional Name: 2-chloro-5-[(N'E)-N'-[1-(10H-phenothiazin-2-yl)ethylidene]hydrazino]benzoic acid Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=CC(=C(C=C1)Cl)C(=O)O)C2=CC3=C(C=C2)SC4=CC=CC=C4N3

Isomeric SMILES

C/C(=N\NC1=CC(=C(C=C1)Cl)C(=O)O)/C2=CC3=C(C=C2)SC4=CC=CC=C4N3

InChI

InChI=1S/C21H16ClN3O2S/c1-12(24-25-14-7-8-16(22)15(11-14)21(26)27)13-6-9-20-18(10-13)23-17-4-2-3-5-19(17)28-20/h2-11,23,25H,1H3,(H,26,27)/b24-12+