2-[2-azanylidene-1,3-bis(2,6-dimethylphenyl)imidazolidin-4-yl]ethanoate hydrochloride

Systemtic Name: 2-[2-azanylidene-1,3-bis(2,6-dimethylphenyl)imidazolidin-4-yl]ethanoate hydrochloride Openeye Name: 2-[1,3-bis(2,6-dimethylphenyl)-2-imino-imidazolidin-4-yl]acetate hydrochloride CAS Name: 2-[1,3-bis(2,6-dimethylphenyl)-2-imino-4-imidazolidinyl]acetate hydrochloride IUPAC Name: 2-[1,3-bis(2,6-dimethylphenyl)-2-iminoimidazolidin-4-yl]acetate hydrochloride Traditional Name: 2-[1,3-bis(2,6-dimethylphenyl)-2-imino-imidazolidin-4-yl]acetate hydrochloride Formula: C21H25ClN3O2- MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CC(N(C2=N)C3=C(C=CC=C3C)C)CC(=O)[O-].Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CC(N(C2=N)C3=C(C=CC=C3C)C)CC(=O)[O-].Cl

InChI

InChI=1S/C21H25N3O2.ClH/c1-13-7-5-8-14(2)19(13)23-12-17(11-18(25)26)24(21(23)22)20-15(3)9-6-10-16(20)4;/h5-10,17,22H,11-12H2,1-4H3,(H,25,26);1H/p-1