aziridin-1-yl-[(2S,4S)-2-(4-oxidanylbutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone

Systemtic Name: aziridin-1-yl-[(2S,4S)-2-(4-oxidanylbutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone Openeye Name: aziridin-1-yl-[(2S,4S)-2-(4-hydroxybutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone CAS Name: 1-aziridinyl-[(2S,4S)-2-(4-hydroxybutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone IUPAC Name: aziridin-1-yl-[(2S,4S)-2-(4-hydroxybutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone Traditional Name: ethylenimino-[(2S,4S)-2-(4-hydroxybutoxy)-4-phenyl-3,4-dihydro-2H-pyran-6-yl]methanone Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C(=O)C2=CC(CC(O2)OCCCCO)C3=CC=CC=C3

Isomeric SMILES

C1CN1C(=O)C2=C[C@H](C[C@H](O2)OCCCCO)C3=CC=CC=C3

InChI

InChI=1S/C18H23NO4/c20-10-4-5-11-22-17-13-15(14-6-2-1-3-7-14)12-16(23-17)18(21)19-8-9-19/h1-3,6-7,12,15,17,20H,4-5,8-11,13H2/t15-,17+/m1/s1