9-hexyl-6,6-dimethyl-10-(phenylmethyl)-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione

Systemtic Name: 9-hexyl-6,6-dimethyl-10-(phenylmethyl)-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione Openeye Name: 10-benzyl-9-hexyl-6,6-dimethyl-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione CAS Name: 9-hexyl-6,6-dimethyl-10-(phenylmethyl)-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione IUPAC Name: 10-benzyl-9-hexyl-6,6-dimethyl-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione Traditional Name: 10-benzyl-9-hexyl-6,6-dimethyl-1-oxa-4,7,10-triazacyclohexadecane-2,5,8-trione Formula: C27H43N3O4 MolecularWeight: 473.64802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=O)NC(C(=O)NCC(=O)OCCCCCCN1CC2=CC=CC=C2)(C)C

Isomeric SMILES

CCCCCCC1C(=O)NC(C(=O)NCC(=O)OCCCCCCN1CC2=CC=CC=C2)(C)C

InChI

InChI=1S/C27H43N3O4/c1-4-5-6-12-17-23-25(32)29-27(2,3)26(33)28-20-24(31)34-19-14-8-7-13-18-30(23)21-22-15-10-9-11-16-22/h9-11,15-16,23H,4-8,12-14,17-21H2,1-3H3,(H,28,33)(H,29,32)