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

Systemtic Name: piperidin-1-yl-[(2S)-4-(4-pyrazol-1-ylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Openeye Name: 1-piperidyl-[(2S)-4-(4-pyrazol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone CAS Name: [(2S)-4-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: piperidin-1-yl-[(2S)-4-(4-pyrazol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Traditional Name: piperidino-[(2S)-4-(4-pyrazol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Formula: C24H24N4O3 MolecularWeight: 416.47236

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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)N5C=CC=N5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C24H24N4O3/c29-23(18-9-11-19(12-10-18)28-16-6-13-25-28)27-17-22(24(30)26-14-4-1-5-15-26)31-21-8-3-2-7-20(21)27/h2-3,6-13,16,22H,1,4-5,14-15,17H2/t22-/m0/s1