N,N-diethyl-1-[3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]phenyl]carbonyl-piperidine-3-carboxamide

Systemtic Name: N,N-diethyl-1-[3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]phenyl]carbonyl-piperidine-3-carboxamide Openeye Name: N,N-diethyl-1-[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzoyl]piperidine-3-carboxamide CAS Name: N,N-diethyl-1-[[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]phenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N,N-diethyl-1-[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzoyl]piperidine-3-carboxamide Traditional Name: N,N-diethyl-1-[4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzoyl]nipecotamide Formula: C30H37N5O6 MolecularWeight: 563.64468

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)[N+](=O)[O-]

InChI

InChI=1S/C30H37N5O6/c1-3-31(4-2)29(37)22-9-7-15-33(19-22)28(36)21-11-12-26(27(18-21)35(39)40)32-16-13-24(14-17-32)34-25-10-6-5-8-23(25)20-41-30(34)38/h5-6,8,10-12,18,22,24H,3-4,7,9,13-17,19-20H2,1-2H3