chloranyl 3,5-bis(azanyl)-2-(2-methylpropyl)benzoate

Systemtic Name: chloranyl 3,5-bis(azanyl)-2-(2-methylpropyl)benzoate Openeye Name: chloro 3,5-diamino-2-isobutyl-benzoate CAS Name: 3,5-diamino-2-(2-methylpropyl)benzoic acid chloro ester IUPAC Name: chloro 3,5-diamino-2-(2-methylpropyl)benzoate Traditional Name: 3,5-diamino-2-isobutyl-benzoic acid chloro ester Formula: C11H15ClN2O2 MolecularWeight: 242.702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1C(=O)OCl)N)N

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1C(=O)OCl)N)N

InChI

InChI=1S/C11H15ClN2O2/c1-6(2)3-8-9(11(15)16-12)4-7(13)5-10(8)14/h4-6H,3,13-14H2,1-2H3