tert-butyl N-[1-(4-carbamimidoylphenyl)-3-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(4-carbamimidoylphenyl)-3-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(4-carbamimidoylphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-(4-carbamimidoylphenyl)-3-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(4-carbamimidoylphenyl)-3-oxopropan-2-yl]carbamate Traditional Name: N-[1-(4-amidinobenzyl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(=N)N)C=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(=N)N)C=O

InChI

InChI=1S/C15H21N3O3/c1-15(2,3)21-14(20)18-12(9-19)8-10-4-6-11(7-5-10)13(16)17/h4-7,9,12H,8H2,1-3H3,(H3,16,17)(H,18,20)