2-[(2S)-6-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(azepan-1-yl)ethanone

Systemtic Name: 2-[(2S)-6-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(azepan-1-yl)ethanone Openeye Name: 2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(azepan-1-yl)ethanone CAS Name: 2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(1-azepanyl)ethanone IUPAC Name: 2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(azepan-1-yl)ethanone Traditional Name: 2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]-1-(azepan-1-yl)ethanone Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)N)CC(=O)N3CCCCCC3

Isomeric SMILES

CC[C@H]1CN(C2=C(O1)C=CC(=C2)N)CC(=O)N3CCCCCC3

InChI

InChI=1S/C18H27N3O2/c1-2-15-12-21(16-11-14(19)7-8-17(16)23-15)13-18(22)20-9-5-3-4-6-10-20/h7-8,11,15H,2-6,9-10,12-13,19H2,1H3/t15-/m0/s1