2-azanyl-2-methyl-propan-1-ol; (E)-octadec-9-enoic acid

Systemtic Name: 2-azanyl-2-methyl-propan-1-ol; (E)-octadec-9-enoic acid Openeye Name: 2-amino-2-methyl-propan-1-ol; (E)-octadec-9-enoic acid CAS Name: 2-amino-2-methyl-1-propanol; (E)-9-octadecenoic acid IUPAC Name: 2-amino-2-methylpropan-1-ol; (E)-octadec-9-enoic acid Traditional Name: 2-amino-2-methyl-propan-1-ol; elaidic acid Formula: C22H45NO3 MolecularWeight: 371.5976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)O.CC(C)(CO)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)O.CC(C)(CO)N

InChI

InChI=1S/C18H34O2.C4H11NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-4(2,5)3-6/h9-10H,2-8,11-17H2,1H3,(H,19,20);6H,3,5H2,1-2H3/b10-9+;