cyclopentyl-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: cyclopentyl-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: cyclopentyl-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: cyclopentyl-[4-(5-nitro-2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: cyclopentyl-[4-(5-nitropyridin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: cyclopentyl-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O3/c21-16(13-4-1-2-5-13)19-9-3-8-18(10-11-19)15-7-6-14(12-17-15)20(22)23/h6-7,12-13H,1-5,8-11H2