2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)xanthen-4-yl]-1-oxidanyl-guanidine

Systemtic Name: 2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)xanthen-4-yl]-1-oxidanyl-guanidine Openeye Name: 2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)xanthen-4-yl]-1-hydroxy-guanidine CAS Name: 2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)-4-xanthenyl]-1-hydroxyguanidine IUPAC Name: 2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)xanthen-4-yl]-1-hydroxyguanidine Traditional Name: 2-[9-(8-azabicyclo[3.2.1]octan-3-ylidene)xanthen-4-yl]-1-hydroxy-guanidine Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(=C3C4=C(C(=CC=C4)N=C(N)NO)OC5=CC=CC=C53)CC1N2

Isomeric SMILES

C1CC2CC(=C3C4=C(C(=CC=C4)N=C(N)NO)OC5=CC=CC=C53)CC1N2

InChI

InChI=1S/C21H22N4O2/c22-21(25-26)24-17-6-3-5-16-19(12-10-13-8-9-14(11-12)23-13)15-4-1-2-7-18(15)27-20(16)17/h1-7,13-14,23,26H,8-11H2,(H3,22,24,25)