tert-butyl carbamate; 4-(phenylmethyl)-N1-propyl-benzene-1,2-diamine

Systemtic Name: tert-butyl carbamate; 4-(phenylmethyl)-N1-propyl-benzene-1,2-diamine Openeye Name: 4-benzyl-N1-propyl-benzene-1,2-diamine; tert-butyl carbamate CAS Name: carbamic acid tert-butyl ester; 4-(phenylmethyl)-N1-propylbenzene-1,2-diamine IUPAC Name: 4-benzyl-1-N-propylbenzene-1,2-diamine; tert-butyl carbamate Traditional Name: (2-amino-4-benzyl-phenyl)-propyl-amine; carbamic acid tert-butyl ester Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)CC2=CC=CC=C2)N.CC(C)(C)OC(=O)N

Isomeric SMILES

CCCNC1=C(C=C(C=C1)CC2=CC=CC=C2)N.CC(C)(C)OC(=O)N

InChI

InChI=1S/C16H20N2.C5H11NO2/c1-2-10-18-16-9-8-14(12-15(16)17)11-13-6-4-3-5-7-13;1-5(2,3)8-4(6)7/h3-9,12,18H,2,10-11,17H2,1H3;1-3H3,(H2,6,7)