N-[(2S,3S,5R)-1-(4-hydroxyphenyl)-7-methyl-5-(methylcarbamoyl)-3-oxidanyl-octan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S,3S,5R)-1-(4-hydroxyphenyl)-7-methyl-5-(methylcarbamoyl)-3-oxidanyl-octan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S,2S,4R)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]-6-methyl-4-(methylcarbamoyl)heptyl]quinoxaline-2-carboxamide CAS Name: N-[(2S,3S,5R)-3-hydroxy-1-(4-hydroxyphenyl)-7-methyl-5-(methylcarbamoyl)octan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S,3S,5R)-3-hydroxy-1-(4-hydroxyphenyl)-7-methyl-5-(methylcarbamoyl)octan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S,2S,4R)-2-hydroxy-1-(4-hydroxybenzyl)-6-methyl-4-(methylcarbamoyl)heptyl]quinoxaline-2-carboxamide Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C(CC1=CC=C(C=C1)O)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)NC

Isomeric SMILES

CC(C)C[C@H](C[C@@H]([C@H](CC1=CC=C(C=C1)O)NC(=O)C2=NC3=CC=CC=C3N=C2)O)C(=O)NC

InChI

InChI=1S/C26H32N4O4/c1-16(2)12-18(25(33)27-3)14-24(32)22(13-17-8-10-19(31)11-9-17)30-26(34)23-15-28-20-6-4-5-7-21(20)29-23/h4-11,15-16,18,22,24,31-32H,12-14H2,1-3H3,(H,27,33)(H,30,34)/t18-,22+,24+/m1/s1