(3S,4S,5S)-4,5-dimethyl-N-(phenylmethyl)hept-6-en-3-amine

Systemtic Name: (3S,4S,5S)-4,5-dimethyl-N-(phenylmethyl)hept-6-en-3-amine Openeye Name: (3S,4S,5S)-N-benzyl-4,5-dimethyl-hept-6-en-3-amine CAS Name: (3S,4S,5S)-4,5-dimethyl-N-(phenylmethyl)-6-hepten-3-amine IUPAC Name: (3S,4S,5S)-N-benzyl-4,5-dimethylhept-6-en-3-amine Traditional Name: benzyl-[(1S,2S,3S)-1-ethyl-2,3-dimethyl-pent-4-enyl]amine Formula: C16H25N MolecularWeight: 231.3764

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C(C)C=C)NCC1=CC=CC=C1

Isomeric SMILES

CC[C@@H]([C@@H](C)[C@@H](C)C=C)NCC1=CC=CC=C1

InChI

InChI=1S/C16H25N/c1-5-13(3)14(4)16(6-2)17-12-15-10-8-7-9-11-15/h5,7-11,13-14,16-17H,1,6,12H2,2-4H3/t13-,14-,16-/m0/s1