2-methoxy-5-nitro-6-nonyl-4-propoxy-3-pyrrolidin-3-yl-benzamide hydrochloride

Systemtic Name: 2-methoxy-5-nitro-6-nonyl-4-propoxy-3-pyrrolidin-3-yl-benzamide hydrochloride Openeye Name: 2-methoxy-5-nitro-6-nonyl-4-propoxy-3-pyrrolidin-3-yl-benzamide hydrochloride CAS Name: 2-methoxy-5-nitro-6-nonyl-4-propoxy-3-(3-pyrrolidinyl)benzamide hydrochloride IUPAC Name: 2-methoxy-5-nitro-6-nonyl-4-propoxy-3-pyrrolidin-3-ylbenzamide hydrochloride Traditional Name: 2-methoxy-5-nitro-6-nonyl-4-propoxy-3-pyrrolidin-3-yl-benzamide hydrochloride Formula: C24H40ClN3O5 MolecularWeight: 486.0445

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C(=C1[N+](=O)[O-])OCCC)C2CCNC2)OC)C(=O)N.Cl

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C(=C1[N+](=O)[O-])OCCC)C2CCNC2)OC)C(=O)N.Cl

InChI

InChI=1S/C24H39N3O5.ClH/c1-4-6-7-8-9-10-11-12-18-20(24(25)28)22(31-3)19(17-13-14-26-16-17)23(32-15-5-2)21(18)27(29)30;/h17,26H,4-16H2,1-3H3,(H2,25,28);1H