3-chloranyl-2-methyl-N-pentan-2-yl-aniline

Systemtic Name: 3-chloranyl-2-methyl-N-pentan-2-yl-aniline Openeye Name: 3-chloro-2-methyl-N-(1-methylbutyl)aniline CAS Name: 3-chloro-2-methyl-N-pentan-2-ylaniline IUPAC Name: 3-chloro-2-methyl-N-pentan-2-ylaniline Traditional Name: (3-chloro-2-methyl-phenyl)-(1-methylbutyl)amine Formula: C12H18ClN MolecularWeight: 211.73102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CCCC(C)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C12H18ClN/c1-4-6-9(2)14-12-8-5-7-11(13)10(12)3/h5,7-9,14H,4,6H2,1-3H3