[(2S)-4-(6-chloranylpyridin-3-yl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-(6-chloranylpyridin-3-yl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-(6-chloropyridine-3-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[(6-chloro-3-pyridinyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-(6-chloropyridine-3-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-(6-chloronicotinoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN3O3/c21-18-9-8-14(12-22-18)19(25)24-13-17(20(26)23-10-4-1-5-11-23)27-16-7-3-2-6-15(16)24/h2-3,6-9,12,17H,1,4-5,10-11,13H2/t17-/m0/s1