tert-butyl N-methylcarbamate; 5-methoxy-2-phenethyl-benzaldehyde

Systemtic Name: tert-butyl N-methylcarbamate; 5-methoxy-2-phenethyl-benzaldehyde Openeye Name: tert-butyl N-methylcarbamate; 5-methoxy-2-phenethyl-benzaldehyde CAS Name: 5-methoxy-2-phenethylbenzaldehyde; N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methylcarbamate; 5-methoxy-2-phenethylbenzaldehyde Traditional Name: 5-methoxy-2-phenethyl-benzaldehyde; N-methylcarbamic acid tert-butyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC.COC1=CC(=C(C=C1)CCC2=CC=CC=C2)C=O

Isomeric SMILES

CC(C)(C)OC(=O)NC.COC1=CC(=C(C=C1)CCC2=CC=CC=C2)C=O

InChI

InChI=1S/C16H16O2.C6H13NO2/c1-18-16-10-9-14(15(11-16)12-17)8-7-13-5-3-2-4-6-13;1-6(2,3)9-5(8)7-4/h2-6,9-12H,7-8H2,1H3;1-4H3,(H,7,8)