ethyl 1-butyl-2-[hex-5-enyl-(phenylmethyl)carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 1-butyl-2-[hex-5-enyl-(phenylmethyl)carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 2-[benzyl(hex-5-enyl)carbamoyl]-1-butyl-aziridine-2-carboxylate CAS Name: 1-butyl-2-[[hex-5-enyl-(phenylmethyl)amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[benzyl(hex-5-enyl)carbamoyl]-1-butylaziridine-2-carboxylate Traditional Name: 2-[benzyl(hex-5-enyl)carbamoyl]-1-butyl-ethylenimine-2-carboxylic acid ethyl ester Formula: C23H34N2O3 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O3/c1-4-7-9-13-16-24(18-20-14-11-10-12-15-20)21(26)23(22(27)28-6-3)19-25(23)17-8-5-2/h4,10-12,14-15H,1,5-9,13,16-19H2,2-3H3