[(2S)-4-(3,4-dichlorophenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-(3,4-dichlorophenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-(3,4-dichlorobenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[(3,4-dichlorophenyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-(3,4-dichlorobenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-(3,4-dichlorobenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O3/c22-15-9-8-14(12-16(15)23)20(26)25-13-19(21(27)24-10-4-1-5-11-24)28-18-7-3-2-6-17(18)25/h2-3,6-9,12,19H,1,4-5,10-11,13H2/t19-/m0/s1