1-(cyclohexylamino)-2-methyl-propan-2-ol; (E)-3-phenylprop-2-enoic acid; hydrochloride

Systemtic Name: 1-(cyclohexylamino)-2-methyl-propan-2-ol; (E)-3-phenylprop-2-enoic acid; hydrochloride Openeye Name: 1-(cyclohexylamino)-2-methyl-propan-2-ol; (E)-3-phenylprop-2-enoic acid; hydrochloride CAS Name: 1-(cyclohexylamino)-2-methyl-2-propanol; (E)-3-phenyl-2-propenoic acid; hydrochloride IUPAC Name: 1-(cyclohexylamino)-2-methylpropan-2-ol; (E)-3-phenylprop-2-enoic acid; hydrochloride Traditional Name: 1-(cyclohexylamino)-2-methyl-propan-2-ol; (E)-3-phenylacrylic acid; hydrochloride Formula: C19H30ClNO3 MolecularWeight: 355.8994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1CCCCC1)O.C1=CC=C(C=C1)C=CC(=O)O.Cl

Isomeric SMILES

CC(C)(CNC1CCCCC1)O.C1=CC=C(C=C1)/C=C/C(=O)O.Cl

InChI

InChI=1S/C10H21NO.C9H8O2.ClH/c1-10(2,12)8-11-9-6-4-3-5-7-9;10-9(11)7-6-8-4-2-1-3-5-8;/h9,11-12H,3-8H2,1-2H3;1-7H,(H,10,11);1H/b;7-6+;