N-(phenylmethyl)-1-(1,4,7,10-tetrazacyclotridec-5-yl)methanamine

Systemtic Name: N-(phenylmethyl)-1-(1,4,7,10-tetrazacyclotridec-5-yl)methanamine Openeye Name: N-benzyl-1-(1,4,7,10-tetrazacyclotridec-5-yl)methanamine CAS Name: N-(phenylmethyl)-1-(1,4,7,10-tetrazacyclotridec-5-yl)methanamine IUPAC Name: N-benzyl-1-(1,4,7,10-tetrazacyclotridec-5-yl)methanamine Traditional Name: benzyl(1,4,7,10-tetrazacyclotridec-5-ylmethyl)amine Formula: C17H31N5 MolecularWeight: 305.46154

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCC(NCCNC1)CNCC2=CC=CC=C2

Isomeric SMILES

C1CNCCNCC(NCCNC1)CNCC2=CC=CC=C2

InChI

InChI=1S/C17H31N5/c1-2-5-16(6-3-1)13-21-15-17-14-20-10-9-18-7-4-8-19-11-12-22-17/h1-3,5-6,17-22H,4,7-15H2