2-dimethylaminoethyl 4-[(E)-2-[(4-propylphenyl)carbonylamino]ethenyl]benzoate hydrochloride

Systemtic Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-propylphenyl)carbonylamino]ethenyl]benzoate hydrochloride Openeye Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-propylbenzoyl)amino]vinyl]benzoate hydrochloride CAS Name: 4-[(E)-2-[[oxo-(4-propylphenyl)methyl]amino]ethenyl]benzoic acid 2-dimethylaminoethyl ester hydrochloride IUPAC Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-propylbenzoyl)amino]ethenyl]benzoate hydrochloride Traditional Name: 4-[(E)-2-[(4-propylbenzoyl)amino]vinyl]benzoic acid 2-dimethylaminoethyl ester hydrochloride Formula: C23H29ClN2O3 MolecularWeight: 416.94096

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)NC=CC2=CC=C(C=C2)C(=O)OCCN(C)C.Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)N/C=C/C2=CC=C(C=C2)C(=O)OCCN(C)C.Cl

InChI

InChI=1S/C23H28N2O3.ClH/c1-4-5-18-6-10-20(11-7-18)22(26)24-15-14-19-8-12-21(13-9-19)23(27)28-17-16-25(2)3;/h6-15H,4-5,16-17H2,1-3H3,(H,24,26);1H/b15-14+;