(Z)-octadec-9-en-1-amine; octadecyl 2-methylprop-2-enoate; prop-2-enoic acid

Systemtic Name: (Z)-octadec-9-en-1-amine; octadecyl 2-methylprop-2-enoate; prop-2-enoic acid Openeye Name: acrylic acid; (Z)-octadec-9-en-1-amine; octadecyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid octadecyl ester; (Z)-9-octadecen-1-amine; 2-propenoic acid IUPAC Name: (Z)-octadec-9-en-1-amine; octadecyl 2-methylprop-2-enoate; prop-2-enoic acid Traditional Name: acrylic acid; 2-methylacrylic acid stearyl ester; [(Z)-octadec-9-enyl]amine Formula: C43H83NO4 MolecularWeight: 678.12342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCCC=CCCCCCCCCN.C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCC/C=C\CCCCCCCCN.C=CC(=O)O

InChI

InChI=1S/C22H42O2.C18H37N.C3H4O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-22(23)21(2)3;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-2-3(4)5/h2,4-20H2,1,3H3;9-10H,2-8,11-19H2,1H3;2H,1H2,(H,4,5)/b;10-9-;