sodium; boron(1-); 4-chloranyl-N1-(3-methylbutyl)-N2-phenyl-benzene-1,2-diamine

Systemtic Name: sodium; boron(1-); 4-chloranyl-N1-(3-methylbutyl)-N2-phenyl-benzene-1,2-diamine Openeye Name: sodium; boron(1-); 4-chloro-N1-isopentyl-N2-phenyl-benzene-1,2-diamine CAS Name: sodium; boron(1-); 4-chloro-N1-(3-methylbutyl)-N2-phenylbenzene-1,2-diamine IUPAC Name: sodium; boron(1-); 4-chloro-1-N-(3-methylbutyl)-2-N-phenylbenzene-1,2-diamine Traditional Name: sodium; (2-anilino-4-chloro-phenyl)-isoamyl-amine; boron(1-) Formula: C17H21BClN2Na MolecularWeight: 322.61581

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Descriptors Computed from Structure

Canonical SMILES:

[B-].CC(C)CCNC1=C(C=C(C=C1)Cl)NC2=CC=CC=C2.[Na+]

Isomeric SMILES

[B-].CC(C)CCNC1=C(C=C(C=C1)Cl)NC2=CC=CC=C2.[Na+]

InChI

InChI=1S/C17H21ClN2.B.Na/c1-13(2)10-11-19-16-9-8-14(18)12-17(16)20-15-6-4-3-5-7-15;;/h3-9,12-13,19-20H,10-11H2,1-2H3;;/q;-1;+1