3-(ethylcarbamoyl)-4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-1-(naphthalen-2-ylmethyl)-2-oxidanylidene-3-piperidin-1-yl-piperidin-1-ium-1-carboxylic acid

Systemtic Name: 3-(ethylcarbamoyl)-4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-1-(naphthalen-2-ylmethyl)-2-oxidanylidene-3-piperidin-1-yl-piperidin-1-ium-1-carboxylic acid Openeye Name: 3-(ethylcarbamoyl)-4-(3-methyl-2-oxo-benzimidazol-1-yl)-1-(2-naphthylmethyl)-2-oxo-3-(1-piperidyl)piperidin-1-ium-1-carboxylic acid CAS Name: 3-(ethylcarbamoyl)-4-(3-methyl-2-oxo-1-benzimidazolyl)-1-(2-naphthalenylmethyl)-2-oxo-3-(1-piperidinyl)-1-piperidin-1-iumcarboxylic acid IUPAC Name: 3-(ethylcarbamoyl)-4-(3-methyl-2-oxobenzimidazol-1-yl)-1-(naphthalen-2-ylmethyl)-2-oxo-3-piperidin-1-ylpiperidin-1-ium-1-carboxylic acid Traditional Name: 3-(ethylcarbamoyl)-2-keto-4-(2-keto-3-methyl-benzimidazol-1-yl)-1-(2-naphthylmethyl)-3-piperidino-piperidin-1-ium-1-carboxylic acid Formula: C33H38N5O5+ MolecularWeight: 584.68532

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1(C(CC[N+](C1=O)(CC2=CC3=CC=CC=C3C=C2)C(=O)O)N4C5=CC=CC=C5N(C4=O)C)N6CCCCC6

Isomeric SMILES

CCNC(=O)C1(C(CC[N+](C1=O)(CC2=CC3=CC=CC=C3C=C2)C(=O)O)N4C5=CC=CC=C5N(C4=O)C)N6CCCCC6

InChI

InChI=1S/C33H37N5O5/c1-3-34-29(39)33(36-18-9-4-10-19-36)28(37-27-14-8-7-13-26(27)35(2)31(37)41)17-20-38(30(33)40,32(42)43)22-23-15-16-24-11-5-6-12-25(24)21-23/h5-8,11-16,21,28H,3-4,9-10,17-20,22H2,1-2H3,(H-,34,39,42,43)/p+1