1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-naphthalen-1-yl-pyrrol-1-ium-1-carboxamide

Systemtic Name: 1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-naphthalen-1-yl-pyrrol-1-ium-1-carboxamide Openeye Name: 1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-(1-naphthyl)pyrrol-1-ium-1-carboxamide CAS Name: 1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-(1-naphthalenyl)-1-pyrrol-1-iumcarboxamide IUPAC Name: 1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-naphthalen-1-ylpyrrol-1-ium-1-carboxamide Traditional Name: 1-(3-ethoxypropyl)-2-(1H-imidazol-5-ylmethyl)-3-(2-methoxyethyl)-N-methyl-4-(1-naphthyl)pyrrol-1-ium-1-carboxamide Formula: C28H35N4O3+ MolecularWeight: 475.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[N+]1(C=C(C(=C1CC2=CN=CN2)CCOC)C3=CC=CC4=CC=CC=C43)C(=O)NC

Isomeric SMILES

CCOCCC[N+]1(C=C(C(=C1CC2=CN=CN2)CCOC)C3=CC=CC4=CC=CC=C43)C(=O)NC

InChI

InChI=1S/C28H34N4O3/c1-4-35-15-8-14-32(28(33)29-2)19-26(24-12-7-10-21-9-5-6-11-23(21)24)25(13-16-34-3)27(32)17-22-18-30-20-31-22/h5-7,9-12,18-20H,4,8,13-17H2,1-3H3,(H-,29,30,31,33)/p+1