2-[2-aminocarbonyl-3-(2-aminocarbonyloxyethyl)-1-propyl-pyridin-1-ium-4-yl]ethyl N-naphthalen-1-ylcarbamate chloride

Systemtic Name: 2-[2-aminocarbonyl-3-(2-aminocarbonyloxyethyl)-1-propyl-pyridin-1-ium-4-yl]ethyl N-naphthalen-1-ylcarbamate chloride Openeye Name: 2-[2-carbamoyl-3-(2-carbamoyloxyethyl)-1-propyl-pyridin-1-ium-4-yl]ethyl N-(1-naphthyl)carbamate chloride CAS Name: N-(1-naphthalenyl)carbamic acid 2-[2-carbamoyl-3-(2-carbamoyloxyethyl)-1-propyl-4-pyridin-1-iumyl]ethyl ester chloride IUPAC Name: 2-[2-carbamoyl-3-(2-carbamoyloxyethyl)-1-propylpyridin-1-ium-4-yl]ethyl N-naphthalen-1-ylcarbamate chloride Traditional Name: N-(1-naphthyl)carbamic acid 2-[2-carbamoyl-3-(2-carbamoyloxyethyl)-1-propyl-pyridin-1-ium-4-yl]ethyl ester chloride Formula: C25H29ClN4O5 MolecularWeight: 500.97456

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C(=C(C=C1)CCOC(=O)NC2=CC=CC3=CC=CC=C32)CCOC(=O)N)C(=O)N.[Cl-]

Isomeric SMILES

CCC[N+]1=C(C(=C(C=C1)CCOC(=O)NC2=CC=CC3=CC=CC=C32)CCOC(=O)N)C(=O)N.[Cl-]

InChI

InChI=1S/C25H28N4O5.ClH/c1-2-13-29-14-10-18(20(22(29)23(26)30)12-16-33-24(27)31)11-15-34-25(32)28-21-9-5-7-17-6-3-4-8-19(17)21;/h3-10,14H,2,11-13,15-16H2,1H3,(H4-,26,27,28,30,31,32);1H