ethyl 1-butyl-2-[pent-4-enyl-(phenylmethyl)carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 1-butyl-2-[pent-4-enyl-(phenylmethyl)carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 2-[benzyl(pent-4-enyl)carbamoyl]-1-butyl-aziridine-2-carboxylate CAS Name: 1-butyl-2-[oxo-[pent-4-enyl-(phenylmethyl)amino]methyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[benzyl(pent-4-enyl)carbamoyl]-1-butylaziridine-2-carboxylate Traditional Name: 2-[benzyl(pent-4-enyl)carbamoyl]-1-butyl-ethylenimine-2-carboxylic acid ethyl ester Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC1(C(=O)N(CCCC=C)CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCN1CC1(C(=O)N(CCCC=C)CC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C22H32N2O3/c1-4-7-12-15-23(17-19-13-10-9-11-14-19)20(25)22(21(26)27-6-3)18-24(22)16-8-5-2/h4,9-11,13-14H,1,5-8,12,15-18H2,2-3H3