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

Systemtic Name: piperidin-1-yl-[(2R)-4-(3-pyrrol-1-ylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Openeye Name: 1-piperidyl-[(2R)-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone CAS Name: [(2R)-4-[oxo-[3-(1-pyrrolyl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: piperidin-1-yl-[(2R)-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Traditional Name: piperidino-[(2R)-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=CC=C4)N5C=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC(=CC=C4)N5C=CC=C5

InChI

InChI=1S/C25H25N3O3/c29-24(19-9-8-10-20(17-19)26-13-6-7-14-26)28-18-23(25(30)27-15-4-1-5-16-27)31-22-12-3-2-11-21(22)28/h2-3,6-14,17,23H,1,4-5,15-16,18H2/t23-/m1/s1