tert-butyl N-[4-azanyl-4-azanylidene-3-(1-benzofuran-3-yl)-2-ethyl-3-methanoyl-2-(4-methoxyphenyl)butanoyl]carbamate

Systemtic Name: tert-butyl N-[4-azanyl-4-azanylidene-3-(1-benzofuran-3-yl)-2-ethyl-3-methanoyl-2-(4-methoxyphenyl)butanoyl]carbamate Openeye Name: tert-butyl N-[4-amino-3-(benzofuran-3-yl)-2-ethyl-3-formyl-4-imino-2-(4-methoxyphenyl)butanoyl]carbamate CAS Name: N-[4-amino-3-(3-benzofuranyl)-2-ethyl-3-formyl-4-imino-2-(4-methoxyphenyl)-1-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-amino-3-(1-benzofuran-3-yl)-2-ethyl-3-formyl-4-imino-2-(4-methoxyphenyl)butanoyl]carbamate Traditional Name: N-[4-amino-3-(benzofuran-3-yl)-2-ethyl-3-formyl-4-imino-2-(4-methoxyphenyl)butanoyl]carbamic acid tert-butyl ester Formula: C27H31N3O6 MolecularWeight: 493.55154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)(C(=O)NC(=O)OC(C)(C)C)C(C=O)(C2=COC3=CC=CC=C32)C(=N)N

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC)(C(=O)NC(=O)OC(C)(C)C)C(C=O)(C2=COC3=CC=CC=C32)C(=N)N

InChI

InChI=1S/C27H31N3O6/c1-6-26(17-11-13-18(34-5)14-12-17,23(32)30-24(33)36-25(2,3)4)27(16-31,22(28)29)20-15-35-21-10-8-7-9-19(20)21/h7-16H,6H2,1-5H3,(H3,28,29)(H,30,32,33)