3-[(4-hydroxyphenyl)methyl]-4,10-dimethyl-13-pentyl-1-oxa-4-azacyclotridecane-2,5-dione

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]-4,10-dimethyl-13-pentyl-1-oxa-4-azacyclotridecane-2,5-dione Openeye Name: 3-[(4-hydroxyphenyl)methyl]-4,10-dimethyl-13-pentyl-1-oxa-4-azacyclotridecane-2,5-dione CAS Name: 3-[(4-hydroxyphenyl)methyl]-4,10-dimethyl-13-pentyl-1-oxa-4-azacyclotridecane-2,5-dione IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-4,10-dimethyl-13-pentyl-1-oxa-4-azacyclotridecane-2,5-dione Traditional Name: 13-amyl-3-(4-hydroxybenzyl)-4,10-dimethyl-1-oxa-4-azacyclotridecane-2,5-quinone Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CCCCC(=O)N(C(C(=O)O1)CC2=CC=C(C=C2)O)C)C

Isomeric SMILES

CCCCCC1CCC(CCCCC(=O)N(C(C(=O)O1)CC2=CC=C(C=C2)O)C)C

InChI

InChI=1S/C25H39NO4/c1-4-5-6-10-22-17-12-19(2)9-7-8-11-24(28)26(3)23(25(29)30-22)18-20-13-15-21(27)16-14-20/h13-16,19,22-23,27H,4-12,17-18H2,1-3H3