ethyl N-[4-(8-acetamido-5-methyl-phenanthridin-5-ium-6-yl)phenyl]carbamate chloride

Systemtic Name: ethyl N-[4-(8-acetamido-5-methyl-phenanthridin-5-ium-6-yl)phenyl]carbamate chloride Openeye Name: ethyl N-[4-(8-acetamido-5-methyl-phenanthridin-5-ium-6-yl)phenyl]carbamate chloride CAS Name: N-[4-(8-acetamido-5-methyl-6-phenanthridin-5-iumyl)phenyl]carbamic acid ethyl ester chloride IUPAC Name: ethyl N-[4-(8-acetamido-5-methylphenanthridin-5-ium-6-yl)phenyl]carbamate chloride Traditional Name: N-[4-(8-acetamido-5-methyl-phenanthridin-5-ium-6-yl)phenyl]carbamic acid ethyl ester chloride Formula: C25H24ClN3O3 MolecularWeight: 449.92936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3C4=C2C=C(C=C4)NC(=O)C)C.[Cl-]

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3C4=C2C=C(C=C4)NC(=O)C)C.[Cl-]

InChI

InChI=1S/C25H23N3O3.ClH/c1-4-31-25(30)27-18-11-9-17(10-12-18)24-22-15-19(26-16(2)29)13-14-20(22)21-7-5-6-8-23(21)28(24)3;/h5-15H,4H2,1-3H3,(H,26,29);1H