12-(phenylmethyl)-1,4,7,13,16-pentaoxa-10,19-diazacyclohenicosane-11,14,18-trione

Systemtic Name: 12-(phenylmethyl)-1,4,7,13,16-pentaoxa-10,19-diazacyclohenicosane-11,14,18-trione Openeye Name: 12-benzyl-1,4,7,13,16-pentaoxa-10,19-diazacyclohenicosane-11,14,18-trione CAS Name: 12-(phenylmethyl)-1,4,7,13,16-pentaoxa-10,19-diazacycloheneicosane-11,14,18-trione IUPAC Name: 12-benzyl-1,4,7,13,16-pentaoxa-10,19-diazacyclohenicosane-11,14,18-trione Traditional Name: 12-benzyl-1,4,7,13,16-pentaoxa-10,19-diazacycloheneicosane-11,14,18-trione Formula: C21H30N2O8 MolecularWeight: 438.4715

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCCNC(=O)C(OC(=O)COCC(=O)N1)CC2=CC=CC=C2

Isomeric SMILES

C1COCCOCCOCCNC(=O)C(OC(=O)COCC(=O)N1)CC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O8/c24-19-15-30-16-20(25)31-18(14-17-4-2-1-3-5-17)21(26)23-7-9-28-11-13-29-12-10-27-8-6-22-19/h1-5,18H,6-16H2,(H,22,24)(H,23,26)