2-diethylaminoethyl 4-[(2-oxidanylideneindol-3-yl)amino]benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-[(2-oxidanylideneindol-3-yl)amino]benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[(2-oxoindol-3-yl)amino]benzoate hydrochloride CAS Name: 4-[(2-oxo-3-indolyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[(2-oxoindol-3-yl)amino]benzoate hydrochloride Traditional Name: 4-[(2-ketoindol-3-yl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC=CC3=NC2=O.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC=CC3=NC2=O.Cl

InChI

InChI=1S/C21H23N3O3.ClH/c1-3-24(4-2)13-14-27-21(26)15-9-11-16(12-10-15)22-19-17-7-5-6-8-18(17)23-20(19)25;/h5-12H,3-4,13-14H2,1-2H3,(H,22,23,25);1H