chloranylmethane; 2-[4-(dimethylamino)-5-methyl-2-propan-2-yl-phenyl]piperidine-1-carboxylate

Systemtic Name: chloranylmethane; 2-[4-(dimethylamino)-5-methyl-2-propan-2-yl-phenyl]piperidine-1-carboxylate Openeye Name: chloromethane; 2-[4-(dimethylamino)-2-isopropyl-5-methyl-phenyl]piperidine-1-carboxylate CAS Name: chloromethane; 2-[4-(dimethylamino)-5-methyl-2-propan-2-ylphenyl]-1-piperidinecarboxylate IUPAC Name: chloromethane; 2-[4-(dimethylamino)-5-methyl-2-propan-2-ylphenyl]piperidine-1-carboxylate Traditional Name: chloromethane; 2-[4-(dimethylamino)-2-isopropyl-5-methyl-phenyl]piperidine-1-carboxylate Formula: C19H30ClN2O2- MolecularWeight: 353.9067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2CCCCN2C(=O)[O-])C(C)C)N(C)C.CCl

Isomeric SMILES

CC1=C(C=C(C(=C1)C2CCCCN2C(=O)[O-])C(C)C)N(C)C.CCl

InChI

InChI=1S/C18H28N2O2.CH3Cl/c1-12(2)14-11-17(19(4)5)13(3)10-15(14)16-8-6-7-9-20(16)18(21)22;1-2/h10-12,16H,6-9H2,1-5H3,(H,21,22);1H3/p-1