N-(2-hydroxyethyl)-3-phenylmethoxy-2-(1,4,7,10-tetrazacyclododec-1-yl)propanamide

Systemtic Name: N-(2-hydroxyethyl)-3-phenylmethoxy-2-(1,4,7,10-tetrazacyclododec-1-yl)propanamide Openeye Name: 3-benzyloxy-N-(2-hydroxyethyl)-2-(1,4,7,10-tetrazacyclododec-1-yl)propanamide CAS Name: N-(2-hydroxyethyl)-3-phenylmethoxy-2-(1,4,7,10-tetrazacyclododec-1-yl)propanamide IUPAC Name: N-(2-hydroxyethyl)-3-phenylmethoxy-2-(1,4,7,10-tetrazacyclododec-1-yl)propanamide Traditional Name: 3-benzoxy-N-(2-hydroxyethyl)-2-(1,4,7,10-tetrazacyclododec-1-yl)propionamide Formula: C20H35N5O3 MolecularWeight: 393.5236

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(CCNCCN1)C(COCC2=CC=CC=C2)C(=O)NCCO

Isomeric SMILES

C1CNCCN(CCNCCN1)C(COCC2=CC=CC=C2)C(=O)NCCO

InChI

InChI=1S/C20H35N5O3/c26-15-12-24-20(27)19(17-28-16-18-4-2-1-3-5-18)25-13-10-22-8-6-21-7-9-23-11-14-25/h1-5,19,21-23,26H,6-17H2,(H,24,27)