2-[3-[(4-carbamimidoylnaphthalen-1-yl)methyl]-2-methyl-6-piperidin-4-yloxy-benzimidazol-5-yl]oxyethanoic acid

Systemtic Name: 2-[3-[(4-carbamimidoylnaphthalen-1-yl)methyl]-2-methyl-6-piperidin-4-yloxy-benzimidazol-5-yl]oxyethanoic acid Openeye Name: 2-[3-[(4-carbamimidoyl-1-naphthyl)methyl]-2-methyl-6-(4-piperidyloxy)benzimidazol-5-yl]oxyacetic acid CAS Name: 2-[[3-[(4-carbamimidoyl-1-naphthalenyl)methyl]-2-methyl-6-(4-piperidinyloxy)-5-benzimidazolyl]oxy]acetic acid IUPAC Name: 2-[3-[(4-carbamimidoylnaphthalen-1-yl)methyl]-2-methyl-6-piperidin-4-yloxybenzimidazol-5-yl]oxyacetic acid Traditional Name: 2-[3-[(4-amidino-1-naphthyl)methyl]-2-methyl-6-(4-piperidyloxy)benzimidazol-5-yl]oxyacetic acid Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2N1CC3=CC=C(C4=CC=CC=C34)C(=N)N)OCC(=O)O)OC5CCNCC5

Isomeric SMILES

CC1=NC2=CC(=C(C=C2N1CC3=CC=C(C4=CC=CC=C34)C(=N)N)OCC(=O)O)OC5CCNCC5

InChI

InChI=1S/C27H29N5O4/c1-16-31-22-12-25(36-18-8-10-30-11-9-18)24(35-15-26(33)34)13-23(22)32(16)14-17-6-7-21(27(28)29)20-5-3-2-4-19(17)20/h2-7,12-13,18,30H,8-11,14-15H2,1H3,(H3,28,29)(H,33,34)