2-diethylaminoethyl 4-azanyl-2-chloranyl-benzoate; 2-dimethylaminoethyl 4-(butylamino)benzoate

Systemtic Name: 2-diethylaminoethyl 4-azanyl-2-chloranyl-benzoate; 2-dimethylaminoethyl 4-(butylamino)benzoate Openeye Name: 2-diethylaminoethyl 4-amino-2-chloro-benzoate; 2-dimethylaminoethyl 4-(butylamino)benzoate CAS Name: 4-amino-2-chlorobenzoic acid 2-diethylaminoethyl ester; 4-(butylamino)benzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-amino-2-chlorobenzoate; 2-dimethylaminoethyl 4-(butylamino)benzoate Traditional Name: 4-amino-2-chloro-benzoic acid 2-diethylaminoethyl ester; 4-(butylamino)benzoic acid 2-dimethylaminoethyl ester Formula: C28H43ClN4O4 MolecularWeight: 535.11842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C.CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl

Isomeric SMILES

CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C.CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl

InChI

InChI=1S/C15H24N2O2.C13H19ClN2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3;1-3-16(4-2)7-8-18-13(17)11-6-5-10(15)9-12(11)14/h6-9,16H,4-5,10-12H2,1-3H3;5-6,9H,3-4,7-8,15H2,1-2H3