(4S)-4-(3-tert-butylphenoxy)-4-(4-methylphenyl)butan-1-amine

Systemtic Name: (4S)-4-(3-tert-butylphenoxy)-4-(4-methylphenyl)butan-1-amine Openeye Name: (4S)-4-(3-tert-butylphenoxy)-4-(p-tolyl)butan-1-amine CAS Name: (4S)-4-(3-tert-butylphenoxy)-4-(4-methylphenyl)-1-butanamine IUPAC Name: (4S)-4-(3-tert-butylphenoxy)-4-(4-methylphenyl)butan-1-amine Traditional Name: [(4S)-4-(3-tert-butylphenoxy)-4-(p-tolyl)butyl]amine Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCCN)OC2=CC=CC(=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CCCN)OC2=CC=CC(=C2)C(C)(C)C

InChI

InChI=1S/C21H29NO/c1-16-10-12-17(13-11-16)20(9-6-14-22)23-19-8-5-7-18(15-19)21(2,3)4/h5,7-8,10-13,15,20H,6,9,14,22H2,1-4H3/t20-/m0/s1