(4S)-4-(4-ethylphenyl)-4-(3-propan-2-ylphenoxy)butan-1-amine

Systemtic Name: (4S)-4-(4-ethylphenyl)-4-(3-propan-2-ylphenoxy)butan-1-amine Openeye Name: (4S)-4-(4-ethylphenyl)-4-(3-isopropylphenoxy)butan-1-amine CAS Name: (4S)-4-(4-ethylphenyl)-4-(3-propan-2-ylphenoxy)-1-butanamine IUPAC Name: (4S)-4-(4-ethylphenyl)-4-(3-propan-2-ylphenoxy)butan-1-amine Traditional Name: [(4S)-4-(4-ethylphenyl)-4-(3-isopropylphenoxy)butyl]amine Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CCCN)OC2=CC=CC(=C2)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CCCN)OC2=CC=CC(=C2)C(C)C

InChI

InChI=1S/C21H29NO/c1-4-17-10-12-18(13-11-17)21(9-6-14-22)23-20-8-5-7-19(15-20)16(2)3/h5,7-8,10-13,15-16,21H,4,6,9,14,22H2,1-3H3/t21-/m0/s1