ethyl N-[4-[2-(ethoxycarbonylamino)-5-methyl-phenanthridin-5-ium-6-yl]phenyl]carbamate chloride

Systemtic Name: ethyl N-[4-[2-(ethoxycarbonylamino)-5-methyl-phenanthridin-5-ium-6-yl]phenyl]carbamate chloride Openeye Name: ethyl N-[4-[2-(ethoxycarbonylamino)-5-methyl-phenanthridin-5-ium-6-yl]phenyl]carbamate chloride CAS Name: N-[4-[2-(ethoxycarbonylamino)-5-methyl-6-phenanthridin-5-iumyl]phenyl]carbamic acid ethyl ester chloride IUPAC Name: ethyl N-[4-[2-(ethoxycarbonylamino)-5-methylphenanthridin-5-ium-6-yl]phenyl]carbamate chloride Traditional Name: N-[4-[2-(carbethoxyamino)-5-methyl-phenanthridin-5-ium-6-yl]phenyl]carbamic acid ethyl ester chloride Formula: C26H26ClN3O4 MolecularWeight: 479.95534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C2=[N+](C3=C(C=C(C=C3)NC(=O)OCC)C4=CC=CC=C42)C.[Cl-]

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C2=[N+](C3=C(C=C(C=C3)NC(=O)OCC)C4=CC=CC=C42)C.[Cl-]

InChI

InChI=1S/C26H25N3O4.ClH/c1-4-32-25(30)27-18-12-10-17(11-13-18)24-21-9-7-6-8-20(21)22-16-19(28-26(31)33-5-2)14-15-23(22)29(24)3;/h6-16H,4-5H2,1-3H3,(H,28,31);1H