3-azanylidene-5-chloranyl-4,7-bis(3-methylbutoxy)isoindol-1-amine

Systemtic Name: 3-azanylidene-5-chloranyl-4,7-bis(3-methylbutoxy)isoindol-1-amine Openeye Name: 5-chloro-3-imino-4,7-diisopentyloxy-isoindol-1-amine CAS Name: 5-chloro-3-imino-4,7-bis(3-methylbutoxy)-1-isoindolamine IUPAC Name: 5-chloro-3-imino-4,7-bis(3-methylbutoxy)isoindol-1-amine Traditional Name: (5-chloro-3-imino-4,7-diisoamoxy-isoindol-1-yl)amine Formula: C18H26ClN3O2 MolecularWeight: 351.87094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC(=C(C2=C1C(=NC2=N)N)OCCC(C)C)Cl

Isomeric SMILES

CC(C)CCOC1=CC(=C(C2=C1C(=NC2=N)N)OCCC(C)C)Cl

InChI

InChI=1S/C18H26ClN3O2/c1-10(2)5-7-23-13-9-12(19)16(24-8-6-11(3)4)15-14(13)17(20)22-18(15)21/h9-11H,5-8H2,1-4H3,(H3,20,21,22)