N-[(4-butoxyphenyl)methyl]-3-chloranyl-2-methyl-aniline

Systemtic Name: N-[(4-butoxyphenyl)methyl]-3-chloranyl-2-methyl-aniline Openeye Name: N-[(4-butoxyphenyl)methyl]-3-chloro-2-methyl-aniline CAS Name: N-[(4-butoxyphenyl)methyl]-3-chloro-2-methylaniline IUPAC Name: N-[(4-butoxyphenyl)methyl]-3-chloro-2-methylaniline Traditional Name: (4-butoxybenzyl)-(3-chloro-2-methyl-phenyl)amine Formula: C18H22ClNO MolecularWeight: 303.82638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C18H22ClNO/c1-3-4-12-21-16-10-8-15(9-11-16)13-20-18-7-5-6-17(19)14(18)2/h5-11,20H,3-4,12-13H2,1-2H3