2-azanyl-4-(2-naphthalen-1-yl-1-piperidin-4-yl-ethyl)benzimidazole-1,5-dicarboxylic acid

Systemtic Name: 2-azanyl-4-(2-naphthalen-1-yl-1-piperidin-4-yl-ethyl)benzimidazole-1,5-dicarboxylic acid Openeye Name: 2-amino-4-[2-(1-naphthyl)-1-(4-piperidyl)ethyl]benzimidazole-1,5-dicarboxylic acid CAS Name: 2-amino-4-[2-(1-naphthalenyl)-1-(4-piperidinyl)ethyl]benzimidazole-1,5-dicarboxylic acid IUPAC Name: 2-amino-4-(2-naphthalen-1-yl-1-piperidin-4-ylethyl)benzimidazole-1,5-dicarboxylic acid Traditional Name: 2-amino-4-[2-(1-naphthyl)-1-(4-piperidyl)ethyl]benzimidazole-1,5-dicarboxylic acid Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(CC2=CC=CC3=CC=CC=C32)C4=C(C=CC5=C4N=C(N5C(=O)O)N)C(=O)O

Isomeric SMILES

C1CNCCC1C(CC2=CC=CC3=CC=CC=C32)C4=C(C=CC5=C4N=C(N5C(=O)O)N)C(=O)O

InChI

InChI=1S/C26H26N4O4/c27-25-29-23-21(30(25)26(33)34)9-8-19(24(31)32)22(23)20(16-10-12-28-13-11-16)14-17-6-3-5-15-4-1-2-7-18(15)17/h1-9,16,20,28H,10-14H2,(H2,27,29)(H,31,32)(H,33,34)