3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 2-(6-methoxynaphthalen-2-yl)propanoate dihydrochloride

Systemtic Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 2-(6-methoxynaphthalen-2-yl)propanoate dihydrochloride Openeye Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 2-(6-methoxy-2-naphthyl)propanoate dihydrochloride CAS Name: 2-(6-methoxy-2-naphthalenyl)propanoic acid 3-[4-(3-nitrooxypropyl)-1-piperazinyl]propyl ester dihydrochloride IUPAC Name: 3-[4-(3-nitrooxypropyl)piperazin-1-yl]propyl 2-(6-methoxynaphthalen-2-yl)propanoate dihydrochloride Traditional Name: 2-(6-methoxy-2-naphthyl)propionic acid 3-[4-(3-nitrooxypropyl)piperazino]propyl ester dihydrochloride Formula: C24H35Cl2N3O6 MolecularWeight: 532.4572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCCN3CCN(CC3)CCCO[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCCN3CCN(CC3)CCCO[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C24H33N3O6.2ClH/c1-19(20-5-6-22-18-23(31-2)8-7-21(22)17-20)24(28)32-15-3-9-25-11-13-26(14-12-25)10-4-16-33-27(29)30;;/h5-8,17-19H,3-4,9-16H2,1-2H3;2*1H