azepan-1-yl-[(3S)-1-(2-nitrophenyl)carbonylpiperidin-3-yl]methanone

Systemtic Name: azepan-1-yl-[(3S)-1-(2-nitrophenyl)carbonylpiperidin-3-yl]methanone Openeye Name: azepan-1-yl-[(3S)-1-(2-nitrobenzoyl)-3-piperidyl]methanone CAS Name: 1-azepanyl-[(3S)-1-[(2-nitrophenyl)-oxomethyl]-3-piperidinyl]methanone IUPAC Name: azepan-1-yl-[(3S)-1-(2-nitrobenzoyl)piperidin-3-yl]methanone Traditional Name: azepan-1-yl-[(3S)-1-(2-nitrobenzoyl)-3-piperidyl]methanone Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCN(C2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@H]2CCCN(C2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O4/c23-18(20-11-5-1-2-6-12-20)15-8-7-13-21(14-15)19(24)16-9-3-4-10-17(16)22(25)26/h3-4,9-10,15H,1-2,5-8,11-14H2/t15-/m0/s1