(2S,5S)-2-butyl-5-(phenylmethyl)-2,3,4,5-tetrahydro-1H-3-benzazepine

Systemtic Name: (2S,5S)-2-butyl-5-(phenylmethyl)-2,3,4,5-tetrahydro-1H-3-benzazepine Openeye Name: (2S,5S)-5-benzyl-2-butyl-2,3,4,5-tetrahydro-1H-3-benzazepine CAS Name: (2S,5S)-2-butyl-5-(phenylmethyl)-2,3,4,5-tetrahydro-1H-3-benzazepine IUPAC Name: (2S,5S)-5-benzyl-2-butyl-2,3,4,5-tetrahydro-1H-3-benzazepine Traditional Name: (2S,5S)-5-benzyl-2-butyl-2,3,4,5-tetrahydro-1H-3-benzazepine Formula: C21H27N MolecularWeight: 293.44578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2=CC=CC=C2C(CN1)CC3=CC=CC=C3

Isomeric SMILES

CCCC[C@H]1CC2=CC=CC=C2[C@@H](CN1)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N/c1-2-3-12-20-15-18-11-7-8-13-21(18)19(16-22-20)14-17-9-5-4-6-10-17/h4-11,13,19-20,22H,2-3,12,14-16H2,1H3/t19-,20+/m1/s1