1-(2,8-dimethylnonan-5-ylamino)propan-2-yl 4-azanylbenzoate hydrochloride

Systemtic Name: 1-(2,8-dimethylnonan-5-ylamino)propan-2-yl 4-azanylbenzoate hydrochloride Openeye Name: [2-[(1-isopentyl-4-methyl-pentyl)amino]-1-methyl-ethyl] 4-aminobenzoate hydrochloride CAS Name: 4-aminobenzoic acid 1-(2,8-dimethylnonan-5-ylamino)propan-2-yl ester hydrochloride IUPAC Name: 1-(2,8-dimethylnonan-5-ylamino)propan-2-yl 4-aminobenzoate hydrochloride Traditional Name: 4-aminobenzoic acid [2-[(1-isoamyl-4-methyl-pentyl)amino]-1-methyl-ethyl] ester hydrochloride Formula: C21H37ClN2O2 MolecularWeight: 384.98368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CCC(C)C)NCC(C)OC(=O)C1=CC=C(C=C1)N.Cl

Isomeric SMILES

CC(C)CCC(CCC(C)C)NCC(C)OC(=O)C1=CC=C(C=C1)N.Cl

InChI

InChI=1S/C21H36N2O2.ClH/c1-15(2)6-12-20(13-7-16(3)4)23-14-17(5)25-21(24)18-8-10-19(22)11-9-18;/h8-11,15-17,20,23H,6-7,12-14,22H2,1-5H3;1H