methyl (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylate

Systemtic Name: methyl (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylate Openeye Name: methyl (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylate CAS Name: (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylic acid methyl ester IUPAC Name: methyl (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylate Traditional Name: (2S,5S)-2-ethyl-2,3,4,5-tetrahydro-1H-1-benzazepine-5-carboxylic acid methyl ester Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C2=CC=CC=C2N1)C(=O)OC

Isomeric SMILES

CC[C@H]1CC[C@@H](C2=CC=CC=C2N1)C(=O)OC

InChI

InChI=1S/C14H19NO2/c1-3-10-8-9-12(14(16)17-2)11-6-4-5-7-13(11)15-10/h4-7,10,12,15H,3,8-9H2,1-2H3/t10-,12-/m0/s1