3-azanyl-3-[(E)-henicos-12-enyl]pentane-1,5-diol; chloranylmethane

Systemtic Name: 3-azanyl-3-[(E)-henicos-12-enyl]pentane-1,5-diol; chloranylmethane Openeye Name: 3-amino-3-[(E)-henicos-12-enyl]pentane-1,5-diol; chloromethane CAS Name: 3-amino-3-[(E)-heneicos-12-enyl]pentane-1,5-diol; chloromethane IUPAC Name: 3-amino-3-[(E)-henicos-12-enyl]pentane-1,5-diol; chloromethane Traditional Name: 3-amino-3-[(E)-heneicos-12-enyl]pentane-1,5-diol; chloromethane Formula: C27H56ClNO2 MolecularWeight: 462.19204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCC(CCO)(CCO)N.CCl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCC(CCO)(CCO)N.CCl

InChI

InChI=1S/C26H53NO2.CH3Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(27,22-24-28)23-25-29;1-2/h9-10,28-29H,2-8,11-25,27H2,1H3;1H3/b10-9+;