(3S)-3-(4-methoxy-3-methyl-phenyl)-N,4,4-trimethyl-pentan-1-amine

Systemtic Name: (3S)-3-(4-methoxy-3-methyl-phenyl)-N,4,4-trimethyl-pentan-1-amine Openeye Name: (3S)-3-(4-methoxy-3-methyl-phenyl)-N,4,4-trimethyl-pentan-1-amine CAS Name: (3S)-3-(4-methoxy-3-methylphenyl)-N,4,4-trimethyl-1-pentanamine IUPAC Name: (3S)-3-(4-methoxy-3-methylphenyl)-N,4,4-trimethylpentan-1-amine Traditional Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-4,4-dimethyl-pentyl]-methyl-amine Formula: C16H27NO MolecularWeight: 249.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CCNC)C(C)(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[C@@H](CCNC)C(C)(C)C)OC

InChI

InChI=1S/C16H27NO/c1-12-11-13(7-8-15(12)18-6)14(9-10-17-5)16(2,3)4/h7-8,11,14,17H,9-10H2,1-6H3/t14-/m1/s1