(1S)-N,N-dibutyl-1-(5-chloranyl-2-methoxy-phenyl)ethane-1,2-diamine

Systemtic Name: (1S)-N,N-dibutyl-1-(5-chloranyl-2-methoxy-phenyl)ethane-1,2-diamine Openeye Name: (1S)-N,N-dibutyl-1-(5-chloro-2-methoxy-phenyl)ethane-1,2-diamine CAS Name: (1S)-N,N-dibutyl-1-(5-chloro-2-methoxyphenyl)ethane-1,2-diamine IUPAC Name: (1S)-N,N-dibutyl-1-(5-chloro-2-methoxyphenyl)ethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(5-chloro-2-methoxy-phenyl)ethyl]-dibutyl-amine Formula: C17H29ClN2O MolecularWeight: 312.87796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(CN)C1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CCCCN(CCCC)[C@H](CN)C1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C17H29ClN2O/c1-4-6-10-20(11-7-5-2)16(13-19)15-12-14(18)8-9-17(15)21-3/h8-9,12,16H,4-7,10-11,13,19H2,1-3H3/t16-/m1/s1