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1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitro-phenoxy]heptanoyl]amino]hexyl ethanoate

1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitro-phenoxy]heptanoyl]amino]hexyl ethanoate

Systemtic Name:1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitro-phenoxy]heptanoyl]amino]hexyl ethanoate
Openeye Name:1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitro-phenoxy]heptanoyl]amino]hexyl acetate
CAS Name:acetic acid 1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitrophenoxy]-1-oxoheptyl]amino]hexyl ester
IUPAC Name:1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitrophenoxy]heptanoyl]amino]hexyl acetate
Traditional Name:acetic acid 1-[cyclohexyl-[7-[3-(1-hydroxyethyl)-4-nitro-phenoxy]heptanoyl]amino]hexyl ester
Formula: C29H46N2O7
MolecularWeight: 534.68474
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(N(C1CCCCC1)C(=O)CCCCCCOC2=CC(=C(C=C2)[N+](=O)[O-])C(C)O)OC(=O)C


Isomeric SMILES

CCCCCC(N(C1CCCCC1)C(=O)CCCCCCOC2=CC(=C(C=C2)[N+](=O)[O-])C(C)O)OC(=O)C


InChI

InChI=1S/C29H46N2O7/c1-4-5-9-17-29(38-23(3)33)30(24-14-10-8-11-15-24)28(34)16-12-6-7-13-20-37-25-18-19-27(31(35)36)26(21-25)22(2)32/h18-19,21-22,24,29,32H,4-17,20H2,1-3H3


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