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

Systemtic Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-ethylphenyl)carbonylamino]ethenyl]benzoate hydrochloride Openeye Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-ethylbenzoyl)amino]vinyl]benzoate hydrochloride CAS Name: 4-[(E)-2-[[(4-ethylphenyl)-oxomethyl]amino]ethenyl]benzoic acid 2-dimethylaminoethyl ester hydrochloride IUPAC Name: 2-dimethylaminoethyl 4-[(E)-2-[(4-ethylbenzoyl)amino]ethenyl]benzoate hydrochloride Traditional Name: 4-[(E)-2-[(4-ethylbenzoyl)amino]vinyl]benzoic acid 2-dimethylaminoethyl ester hydrochloride Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC=CC2=CC=C(C=C2)C(=O)OCCN(C)C.Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N/C=C/C2=CC=C(C=C2)C(=O)OCCN(C)C.Cl

InChI

InChI=1S/C22H26N2O3.ClH/c1-4-17-5-9-19(10-6-17)21(25)23-14-13-18-7-11-20(12-8-18)22(26)27-16-15-24(2)3;/h5-14H,4,15-16H2,1-3H3,(H,23,25);1H/b14-13+;