1-(1-adamantyl)-3-anthracen-1-yl-1,3-dimethyl-guanidine

Systemtic Name: 1-(1-adamantyl)-3-anthracen-1-yl-1,3-dimethyl-guanidine Openeye Name: 1-(1-adamantyl)-3-(1-anthryl)-1,3-dimethyl-guanidine CAS Name: 1-(1-adamantyl)-3-(1-anthracenyl)-1,3-dimethylguanidine IUPAC Name: 1-(1-adamantyl)-3-anthracen-1-yl-1,3-dimethylguanidine Traditional Name: 1-(1-adamantyl)-3-(1-anthryl)-1,3-dimethyl-guanidine Formula: C27H31N3 MolecularWeight: 397.55514

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC2=CC3=CC=CC=C3C=C21)C(=N)N(C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN(C1=CC=CC2=CC3=CC=CC=C3C=C21)C(=N)N(C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H31N3/c1-29(25-9-5-8-23-13-21-6-3-4-7-22(21)14-24(23)25)26(28)30(2)27-15-18-10-19(16-27)12-20(11-18)17-27/h3-9,13-14,18-20,28H,10-12,15-17H2,1-2H3