tert-butyl 2-[(4-carbamimidoylphenyl)methylamino]but-3-enoate

Systemtic Name: tert-butyl 2-[(4-carbamimidoylphenyl)methylamino]but-3-enoate Openeye Name: tert-butyl 2-[(4-carbamimidoylphenyl)methylamino]but-3-enoate CAS Name: 2-[(4-carbamimidoylphenyl)methylamino]-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-carbamimidoylphenyl)methylamino]but-3-enoate Traditional Name: 2-[(4-amidinobenzyl)amino]but-3-enoic acid tert-butyl ester Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C=C)NCC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)C(C=C)NCC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C16H23N3O2/c1-5-13(15(20)21-16(2,3)4)19-10-11-6-8-12(9-7-11)14(17)18/h5-9,13,19H,1,10H2,2-4H3,(H3,17,18)