N-[(3-butoxyphenyl)methyl]-5-chloranyl-2-methyl-aniline

Systemtic Name: N-[(3-butoxyphenyl)methyl]-5-chloranyl-2-methyl-aniline Openeye Name: N-[(3-butoxyphenyl)methyl]-5-chloro-2-methyl-aniline CAS Name: N-[(3-butoxyphenyl)methyl]-5-chloro-2-methylaniline IUPAC Name: N-[(3-butoxyphenyl)methyl]-5-chloro-2-methylaniline Traditional Name: (3-butoxybenzyl)-(5-chloro-2-methyl-phenyl)amine Formula: C18H22ClNO MolecularWeight: 303.82638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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