2-[1-(4-hydroxyphenyl)-3-(1,4,7,10-tetrazacyclododec-1-yl)propan-2-yl]guanidine

Systemtic Name: 2-[1-(4-hydroxyphenyl)-3-(1,4,7,10-tetrazacyclododec-1-yl)propan-2-yl]guanidine Openeye Name: 2-[1-[(4-hydroxyphenyl)methyl]-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]guanidine CAS Name: 2-[1-(4-hydroxyphenyl)-3-(1,4,7,10-tetrazacyclododec-1-yl)propan-2-yl]guanidine IUPAC Name: 2-[1-(4-hydroxyphenyl)-3-(1,4,7,10-tetrazacyclododec-1-yl)propan-2-yl]guanidine Traditional Name: 2-[1-(4-hydroxybenzyl)-2-(1,4,7,10-tetrazacyclododec-1-yl)ethyl]guanidine Formula: C18H33N7O MolecularWeight: 363.50092

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(CCNCCN1)CC(CC2=CC=C(C=C2)O)N=C(N)N

Isomeric SMILES

C1CNCCN(CCNCCN1)CC(CC2=CC=C(C=C2)O)N=C(N)N

InChI

InChI=1S/C18H33N7O/c19-18(20)24-16(13-15-1-3-17(26)4-2-15)14-25-11-9-22-7-5-21-6-8-23-10-12-25/h1-4,16,21-23,26H,5-14H2,(H4,19,20,24)