4-[4-chloranyl-3-methyl-2-(phenylmethyl)-6-propan-2-yl-phenoxy]-N-methyl-butan-1-amine

Systemtic Name: 4-[4-chloranyl-3-methyl-2-(phenylmethyl)-6-propan-2-yl-phenoxy]-N-methyl-butan-1-amine Openeye Name: 4-(2-benzyl-4-chloro-6-isopropyl-3-methyl-phenoxy)-N-methyl-butan-1-amine CAS Name: 4-[4-chloro-3-methyl-2-(phenylmethyl)-6-propan-2-ylphenoxy]-N-methyl-1-butanamine IUPAC Name: 4-(2-benzyl-4-chloro-3-methyl-6-propan-2-ylphenoxy)-N-methylbutan-1-amine Traditional Name: 4-(2-benzyl-4-chloro-6-isopropyl-3-methyl-phenoxy)butyl-methyl-amine Formula: C22H30ClNO MolecularWeight: 359.9327

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1CC2=CC=CC=C2)OCCCCNC)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1CC2=CC=CC=C2)OCCCCNC)C(C)C)Cl

InChI

InChI=1S/C22H30ClNO/c1-16(2)19-15-21(23)17(3)20(14-18-10-6-5-7-11-18)22(19)25-13-9-8-12-24-4/h5-7,10-11,15-16,24H,8-9,12-14H2,1-4H3