[2-(ethylamino)-3-methyl-nonyl] 4-nitrobenzoate hydrochloride

Systemtic Name: [2-(ethylamino)-3-methyl-nonyl] 4-nitrobenzoate hydrochloride Openeye Name: [2-(ethylamino)-3-methyl-nonyl] 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid [2-(ethylamino)-3-methylnonyl] ester hydrochloride IUPAC Name: [2-(ethylamino)-3-methylnonyl] 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid [2-(ethylamino)-3-methyl-nonyl] ester hydrochloride Formula: C19H31ClN2O4 MolecularWeight: 386.91344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])NCC.Cl

Isomeric SMILES

CCCCCCC(C)C(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])NCC.Cl

InChI

InChI=1S/C19H30N2O4.ClH/c1-4-6-7-8-9-15(3)18(20-5-2)14-25-19(22)16-10-12-17(13-11-16)21(23)24;/h10-13,15,18,20H,4-9,14H2,1-3H3;1H