6-[(1S)-1-azanylethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanylethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-aminoethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-aminoethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-aminoethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-aminoethyl]-4-[3-(4-methoxyphenoxy)propyl]-1,4-benzoxazin-3-one Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2CCCOC3=CC=C(C=C3)OC)N

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CCCOC3=CC=C(C=C3)OC)N

InChI

InChI=1S/C20H24N2O4/c1-14(21)15-4-9-19-18(12-15)22(20(23)13-26-19)10-3-11-25-17-7-5-16(24-2)6-8-17/h4-9,12,14H,3,10-11,13,21H2,1-2H3/t14-/m0/s1