1-[1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]piperidin-4-yl]carbonyl-1,4-diazepan-5-one

Systemtic Name: 1-[1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]piperidin-4-yl]carbonyl-1,4-diazepan-5-one Openeye Name: 1-[1-[1-(1,3-benzoxazol-2-yl)-4-piperidyl]piperidine-4-carbonyl]-1,4-diazepan-5-one CAS Name: 1-[[1-[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-4-piperidinyl]-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 1-[1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]piperidine-4-carbonyl]-1,4-diazepan-5-one Traditional Name: 1-[1-[1-(1,3-benzoxazol-2-yl)-4-piperidyl]isonipecotoyl]-1,4-diazepan-5-one Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC(=O)NCC2)C3CCN(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC(=O)NCC2)C3CCN(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C23H31N5O3/c29-21-9-15-27(16-10-24-21)22(30)17-5-11-26(12-6-17)18-7-13-28(14-8-18)23-25-19-3-1-2-4-20(19)31-23/h1-4,17-18H,5-16H2,(H,24,29)