butane; N-[(E,1R,2R)-1-methoxy-2-oxidanyl-nonadec-3-enyl]tetradecanamide; octane

Systemtic Name: butane; N-[(E,1R,2R)-1-methoxy-2-oxidanyl-nonadec-3-enyl]tetradecanamide; octane Openeye Name: butane; N-[(E,1R,2R)-2-hydroxy-1-methoxy-nonadec-3-enyl]tetradecanamide; octane CAS Name: butane; N-[(E,1R,2R)-2-hydroxy-1-methoxynonadec-3-enyl]tetradecanamide; octane IUPAC Name: butane; N-[(E,1R,2R)-2-hydroxy-1-methoxynonadec-3-enyl]tetradecanamide; octane Traditional Name: N-[(E,1R,2R)-2-hydroxy-1-methoxy-nonadec-3-enyl]myristamide; n-butane; n-octane Formula: C46H95NO3 MolecularWeight: 710.2514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCCCCCC.CCCCCCCCCCCCCCCC=CC(C(NC(=O)CCCCCCCCCCCCC)OC)O

Isomeric SMILES

CCCC.CCCCCCCC.CCCCCCCCCCCCCCC/C=C/[C@H]([C@H](NC(=O)CCCCCCCCCCCCC)OC)O

InChI

InChI=1S/C34H67NO3.C8H18.C4H10/c1-4-6-8-10-12-14-16-17-18-19-21-22-24-26-28-30-32(36)34(38-3)35-33(37)31-29-27-25-23-20-15-13-11-9-7-5-2;1-3-5-7-8-6-4-2;1-3-4-2/h28,30,32,34,36H,4-27,29,31H2,1-3H3,(H,35,37);3-8H2,1-2H3;3-4H2,1-2H3/b30-28+;;/t32-,34-;;/m1../s1