(4-methylpiperazin-1-yl)-(3-nitroazulen-1-yl)methanone hydrochloride

Systemtic Name: (4-methylpiperazin-1-yl)-(3-nitroazulen-1-yl)methanone hydrochloride Openeye Name: (4-methylpiperazin-1-yl)-(3-nitroazulen-1-yl)methanone hydrochloride CAS Name: (4-methyl-1-piperazinyl)-(3-nitro-1-azulenyl)methanone hydrochloride IUPAC Name: (4-methylpiperazin-1-yl)-(3-nitroazulen-1-yl)methanone hydrochloride Traditional Name: (4-methylpiperazino)-(3-nitroazulen-1-yl)methanone hydrochloride Formula: C16H18ClN3O3 MolecularWeight: 335.78542

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC(=C3C2=CC=CC=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC(=C3C2=CC=CC=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H17N3O3.ClH/c1-17-7-9-18(10-8-17)16(20)14-11-15(19(21)22)13-6-4-2-3-5-12(13)14;/h2-6,11H,7-10H2,1H3;1H