methyl 2-[[1-[(2,4,6-trimethoxyphenyl)methyl]aziridin-2-yl]carbonylamino]pent-4-ynoate

Systemtic Name: methyl 2-[[1-[(2,4,6-trimethoxyphenyl)methyl]aziridin-2-yl]carbonylamino]pent-4-ynoate Openeye Name: methyl 2-[[1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carbonyl]amino]pent-4-ynoate CAS Name: 2-[[oxo-[1-[(2,4,6-trimethoxyphenyl)methyl]-2-aziridinyl]methyl]amino]-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[[1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carbonyl]amino]pent-4-ynoate Traditional Name: 2-[[1-(2,4,6-trimethoxybenzyl)ethylenimine-2-carbonyl]amino]pent-4-ynoic acid methyl ester Formula: C19H24N2O6 MolecularWeight: 376.40366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CN2CC2C(=O)NC(CC#C)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CN2CC2C(=O)NC(CC#C)C(=O)OC)OC

InChI

InChI=1S/C19H24N2O6/c1-6-7-14(19(23)27-5)20-18(22)15-11-21(15)10-13-16(25-3)8-12(24-2)9-17(13)26-4/h1,8-9,14-15H,7,10-11H2,2-5H3,(H,20,22)