1-[6-oxidanylidene-6-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea

Systemtic Name: 1-[6-oxidanylidene-6-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea Openeye Name: [6-oxo-6-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea CAS Name: [6-oxo-6-[(2S)-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea IUPAC Name: [6-oxo-6-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea Traditional Name: [6-keto-6-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]hexyl]urea Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)CCCCCNC(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O4/c22-21(28)23-12-6-1-3-11-19(26)25-15-18(20(27)24-13-7-2-8-14-24)29-17-10-5-4-9-16(17)25/h4-5,9-10,18H,1-3,6-8,11-15H2,(H3,22,23,28)/t18-/m0/s1