4-[[(3S)-1-azabicyclo[2.2.2]octan-3-yl]amino]-3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodanyl-quinolin-2-one

Systemtic Name: 4-[[(3S)-1-azabicyclo[2.2.2]octan-3-yl]amino]-3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodanyl-quinolin-2-one Openeye Name: 3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodo-4-[[(3S)-quinuclidin-3-yl]amino]quinolin-2-one CAS Name: 4-[[(3S)-1-azabicyclo[2.2.2]octan-3-yl]amino]-3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodo-2-quinolinone IUPAC Name: 4-[[(3S)-1-azabicyclo[2.2.2]octan-3-yl]amino]-3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodoquinolin-2-one Traditional Name: 3-(1,3-dihydrobenzimidazol-2-ylidene)-6-iodo-4-[[(3S)-quinuclidin-3-yl]amino]carbostyril Formula: C23H22IN5O MolecularWeight: 511.35815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C4C=C(C=CC4=NC(=O)C3=C5NC6=CC=CC=C6N5)I

Isomeric SMILES

C1CN2CCC1[C@@H](C2)NC3=C4C=C(C=CC4=NC(=O)C3=C5NC6=CC=CC=C6N5)I

InChI

InChI=1S/C23H22IN5O/c24-14-5-6-16-15(11-14)21(25-19-12-29-9-7-13(19)8-10-29)20(23(30)28-16)22-26-17-3-1-2-4-18(17)27-22/h1-6,11,13,19,25-27H,7-10,12H2/t19-/m1/s1