tert-butyl N-[1-azanyl-2-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butan-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[1-azanyl-2-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[1-(aminomethyl)-1-(3,4-dichlorophenyl)-3-tetrahydropyran-2-yloxy-propyl]-N-methyl-carbamate CAS Name: N-[1-amino-2-(3,4-dichlorophenyl)-4-(2-oxanyloxy)butan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-amino-2-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butan-2-yl]-N-methylcarbamate Traditional Name: N-[1-(aminomethyl)-1-(3,4-dichlorophenyl)-3-tetrahydropyran-2-yloxy-propyl]-N-methyl-carbamic acid tert-butyl ester Formula: C21H32Cl2N2O4 MolecularWeight: 447.39578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C(CCOC1CCCCO1)(CN)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C(CCOC1CCCCO1)(CN)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H32Cl2N2O4/c1-20(2,3)29-19(26)25(4)21(14-24,15-8-9-16(22)17(23)13-15)10-12-28-18-7-5-6-11-27-18/h8-9,13,18H,5-7,10-12,14,24H2,1-4H3