4-(4-chloranylbutan-2-ylamino)-2-methyl-benzaldehyde

Systemtic Name: 4-(4-chloranylbutan-2-ylamino)-2-methyl-benzaldehyde Openeye Name: 4-[(3-chloro-1-methyl-propyl)amino]-2-methyl-benzaldehyde CAS Name: 4-(4-chlorobutan-2-ylamino)-2-methylbenzaldehyde IUPAC Name: 4-(4-chlorobutan-2-ylamino)-2-methylbenzaldehyde Traditional Name: 4-[(3-chloro-1-methyl-propyl)amino]-2-methyl-benzaldehyde Formula: C12H16ClNO MolecularWeight: 225.71454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(C)CCCl)C=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(C)CCCl)C=O

InChI

InChI=1S/C12H16ClNO/c1-9-7-12(4-3-11(9)8-15)14-10(2)5-6-13/h3-4,7-8,10,14H,5-6H2,1-2H3