4-(2,4-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol hydrochloride

Systemtic Name: 4-(2,4-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol hydrochloride Openeye Name: 4-(2,4-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-chroman-3-ol hydrochloride CAS Name: 4-(2,4-dimethyl-1-pyrrolidinyl)-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol hydrochloride IUPAC Name: 4-(2,4-dimethylpyrrolidin-1-yl)-2,2-dimethyl-6-nitro-3,4-dihydrochromen-3-ol hydrochloride Traditional Name: 4-(2,4-dimethylpyrrolidino)-2,2-dimethyl-6-nitro-chroman-3-ol hydrochloride Formula: C17H25ClN2O4 MolecularWeight: 356.8444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)C.Cl

Isomeric SMILES

CC1CC(N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)C.Cl

InChI

InChI=1S/C17H24N2O4.ClH/c1-10-7-11(2)18(9-10)15-13-8-12(19(21)22)5-6-14(13)23-17(3,4)16(15)20;/h5-6,8,10-11,15-16,20H,7,9H2,1-4H3;1H