(3S)-3-piperidin-1-yl-4-(2,3,6-trimethylphenoxy)butan-1-amine

Systemtic Name: (3S)-3-piperidin-1-yl-4-(2,3,6-trimethylphenoxy)butan-1-amine Openeye Name: (3S)-3-(1-piperidyl)-4-(2,3,6-trimethylphenoxy)butan-1-amine CAS Name: (3S)-3-(1-piperidinyl)-4-(2,3,6-trimethylphenoxy)-1-butanamine IUPAC Name: (3S)-3-piperidin-1-yl-4-(2,3,6-trimethylphenoxy)butan-1-amine Traditional Name: [(3S)-3-piperidino-4-(2,3,6-trimethylphenoxy)butyl]amine Formula: C18H30N2O MolecularWeight: 290.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CCN)N2CCCCC2)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC[C@H](CCN)N2CCCCC2)C

InChI

InChI=1S/C18H30N2O/c1-14-7-8-15(2)18(16(14)3)21-13-17(9-10-19)20-11-5-4-6-12-20/h7-8,17H,4-6,9-13,19H2,1-3H3/t17-/m0/s1