6-[(1S)-1-azanylethyl]-4-[(3,4-dichlorophenyl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanylethyl]-4-[(3,4-dichlorophenyl)methyl]-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-aminoethyl]-4-[(3,4-dichlorophenyl)methyl]-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-aminoethyl]-4-[(3,4-dichlorophenyl)methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-aminoethyl]-4-[(3,4-dichlorophenyl)methyl]-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-aminoethyl]-4-(3,4-dichlorobenzyl)-1,4-benzoxazin-3-one Formula: C17H16Cl2N2O2 MolecularWeight: 351.22714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2CC3=CC(=C(C=C3)Cl)Cl)N

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC3=CC(=C(C=C3)Cl)Cl)N

InChI

InChI=1S/C17H16Cl2N2O2/c1-10(20)12-3-5-16-15(7-12)21(17(22)9-23-16)8-11-2-4-13(18)14(19)6-11/h2-7,10H,8-9,20H2,1H3/t10-/m0/s1