(2R)-6-[(1S)-1-azanylpropyl]-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-[(1S)-1-azanylpropyl]-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminopropyl]-4-benzyl-2-ethyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminopropyl]-2-ethyl-4-(phenylmethyl)-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminopropyl]-4-benzyl-2-ethyl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminopropyl]-4-benzyl-2-ethyl-1,4-benzoxazin-3-one Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(CC)N)CC3=CC=CC=C3

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)[C@H](CC)N)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c1-3-16(21)15-10-11-19-17(12-15)22(20(23)18(4-2)24-19)13-14-8-6-5-7-9-14/h5-12,16,18H,3-4,13,21H2,1-2H3/t16-,18+/m0/s1