(5R,6R)-1-ethanoyl-6-oxidanyl-5-(phenylmethyl)-2,4-dipropyl-1,2,4-triazepan-3-one

Systemtic Name: (5R,6R)-1-ethanoyl-6-oxidanyl-5-(phenylmethyl)-2,4-dipropyl-1,2,4-triazepan-3-one Openeye Name: (5R,6R)-1-acetyl-5-benzyl-6-hydroxy-2,4-dipropyl-1,2,4-triazepan-3-one CAS Name: (5R,6R)-1-acetyl-6-hydroxy-5-(phenylmethyl)-2,4-dipropyl-1,2,4-triazepan-3-one IUPAC Name: (5R,6R)-1-acetyl-5-benzyl-6-hydroxy-2,4-dipropyl-1,2,4-triazepan-3-one Traditional Name: (5R,6R)-1-acetyl-5-benzyl-6-hydroxy-2,4-dipropyl-1,2,4-triazepan-3-one Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(CN(N(C1=O)CCC)C(=O)C)O)CC2=CC=CC=C2

Isomeric SMILES

CCCN1[C@@H]([C@@H](CN(N(C1=O)CCC)C(=O)C)O)CC2=CC=CC=C2

InChI

InChI=1S/C19H29N3O3/c1-4-11-20-17(13-16-9-7-6-8-10-16)18(24)14-22(15(3)23)21(12-5-2)19(20)25/h6-10,17-18,24H,4-5,11-14H2,1-3H3/t17-,18-/m1/s1