(1S)-2-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-1-naphthalen-1-yl-ethanol

Systemtic Name: (1S)-2-[2-azanylidene-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-1-naphthalen-1-yl-ethanol Openeye Name: (1S)-2-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-1-(1-naphthyl)ethanol CAS Name: (1S)-2-[2-imino-3-[2-(1-piperidin-1-iumyl)ethyl]-1-benzimidazolyl]-1-(1-naphthalenyl)ethanol IUPAC Name: (1S)-2-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-1-naphthalen-1-ylethanol Traditional Name: (1S)-2-[2-imino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-yl]-1-(1-naphthyl)ethanol Formula: C26H31N4O+ MolecularWeight: 415.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N(C2=N)CC(C4=CC=CC5=CC=CC=C54)O

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N(C2=N)C[C@H](C4=CC=CC5=CC=CC=C54)O

InChI

InChI=1S/C26H30N4O/c27-26-29(18-17-28-15-6-1-7-16-28)23-13-4-5-14-24(23)30(26)19-25(31)22-12-8-10-20-9-2-3-11-21(20)22/h2-5,8-14,25,27,31H,1,6-7,15-19H2/p+1/t25-/m1/s1