1-[8-(4-azanyl-2-oxidanylidene-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine

Systemtic Name: 1-[8-(4-azanyl-2-oxidanylidene-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine Openeye Name: 1-[8-(4-amino-2-oxo-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine CAS Name: 1-[8-(4-amino-2-oxo-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine IUPAC Name: 1-[8-(4-amino-2-oxo-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine Traditional Name: 1-[8-(4-amino-2-keto-1,3,5-triazacyclotridec-4-en-1-yl)octyl]-2-(cyclopropylmethyl)guanidine Formula: C23H45N7O MolecularWeight: 435.6497

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCN(C(=O)NC(=NCCC1)N)CCCCCCCCNC(=NCC2CC2)N

Isomeric SMILES

C1CCCCN(C(=O)NC(=NCCC1)N)CCCCCCCCNC(=NCC2CC2)N

InChI

InChI=1S/C23H45N7O/c24-21(28-19-20-13-14-20)26-15-9-5-1-3-7-11-17-30-18-12-8-4-2-6-10-16-27-22(25)29-23(30)31/h20H,1-19H2,(H3,24,26,28)(H3,25,27,29,31)