2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)anthracen-9-yl]methyl]guanidine

Systemtic Name: 2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)anthracen-9-yl]methyl]guanidine Openeye Name: 2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)-9-anthryl]methyl]guanidine CAS Name: 2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)-9-anthracenyl]methyl]guanidine IUPAC Name: 2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)anthracen-9-yl]methyl]guanidine Traditional Name: 2-[[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)-9-anthryl]methyl]guanidine Formula: C29H40N4O5 MolecularWeight: 524.6517

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCCOCCOCCN1CC2=C3C=CC=CC3=C(C4=CC=CC=C42)CN=C(N)N

Isomeric SMILES

C1COCCOCCOCCOCCOCCN1CC2=C3C=CC=CC3=C(C4=CC=CC=C42)CN=C(N)N

InChI

InChI=1S/C29H40N4O5/c30-29(31)32-21-27-23-5-1-3-7-25(23)28(26-8-4-2-6-24(26)27)22-33-9-11-34-13-15-36-17-19-38-20-18-37-16-14-35-12-10-33/h1-8H,9-22H2,(H4,30,31,32)