(2-oxidanyl-3-phenylazanyl-propyl) 4-(butylamino)benzoate hydrochloride

Systemtic Name: (2-oxidanyl-3-phenylazanyl-propyl) 4-(butylamino)benzoate hydrochloride Openeye Name: (3-anilino-2-hydroxy-propyl) 4-(butylamino)benzoate hydrochloride CAS Name: 4-(butylamino)benzoic acid (3-anilino-2-hydroxypropyl) ester hydrochloride IUPAC Name: (3-anilino-2-hydroxypropyl) 4-(butylamino)benzoate hydrochloride Traditional Name: 4-(butylamino)benzoic acid (3-anilino-2-hydroxy-propyl) ester hydrochloride Formula: C20H27ClN2O3 MolecularWeight: 378.89298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=C(C=C1)C(=O)OCC(CNC2=CC=CC=C2)O.Cl

Isomeric SMILES

CCCCNC1=CC=C(C=C1)C(=O)OCC(CNC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C20H26N2O3.ClH/c1-2-3-13-21-18-11-9-16(10-12-18)20(24)25-15-19(23)14-22-17-7-5-4-6-8-17;/h4-12,19,21-23H,2-3,13-15H2,1H3;1H