1H-benzimidazol-2-ylmethyl-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: 1H-benzimidazol-2-ylmethyl-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: 1H-benzimidazol-2-ylmethyl-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: 1H-benzimidazol-2-ylmethyl-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: 1H-benzimidazol-2-ylmethyl-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-5-oxopyrrolidin-3-yl]azanium Traditional Name: 1H-benzimidazol-2-ylmethyl-[(3R)-5-keto-1-[2-(4-methoxyphenyl)ethyl]pyrrolidin-3-yl]ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2CC(CC2=O)[NH2+]CC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C[C@@H](CC2=O)[NH2+]CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N4O2/c1-27-17-8-6-15(7-9-17)10-11-25-14-16(12-21(25)26)22-13-20-23-18-4-2-3-5-19(18)24-20/h2-9,16,22H,10-14H2,1H3,(H,23,24)/p+1/t16-/m1/s1