[(E)-4-(dimethylamino)butan-2-ylideneamino] benzoate hydrochloride

Systemtic Name: [(E)-4-(dimethylamino)butan-2-ylideneamino] benzoate hydrochloride Openeye Name: [(E)-[3-(dimethylamino)-1-methyl-propylidene]amino] benzoate hydrochloride CAS Name: benzoic acid [(E)-4-(dimethylamino)butan-2-ylideneamino] ester hydrochloride IUPAC Name: [(E)-4-(dimethylamino)butan-2-ylideneamino] benzoate hydrochloride Traditional Name: benzoic acid [(E)-[3-(dimethylamino)-1-methyl-propylidene]amino] ester hydrochloride Formula: C13H19ClN2O2 MolecularWeight: 270.75516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC=CC=C1)CCN(C)C.Cl

Isomeric SMILES

C/C(=N\OC(=O)C1=CC=CC=C1)/CCN(C)C.Cl

InChI

InChI=1S/C13H18N2O2.ClH/c1-11(9-10-15(2)3)14-17-13(16)12-7-5-4-6-8-12;/h4-8H,9-10H2,1-3H3;1H/b14-11+;