ethyl 4-(hexylamino)-2-[methyl(2-prop-2-enoxyethanoyl)amino]benzoate

Systemtic Name: ethyl 4-(hexylamino)-2-[methyl(2-prop-2-enoxyethanoyl)amino]benzoate Openeye Name: ethyl 2-[(2-allyloxyacetyl)-methyl-amino]-4-(hexylamino)benzoate CAS Name: 4-(hexylamino)-2-[methyl-(1-oxo-2-prop-2-enoxyethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(hexylamino)-2-[methyl-(2-prop-2-enoxyacetyl)amino]benzoate Traditional Name: 2-[(2-allyloxyacetyl)-methyl-amino]-4-(hexylamino)benzoic acid ethyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC(=C(C=C1)C(=O)OCC)N(C)C(=O)COCC=C

Isomeric SMILES

CCCCCCNC1=CC(=C(C=C1)C(=O)OCC)N(C)C(=O)COCC=C

InChI

InChI=1S/C21H32N2O4/c1-5-8-9-10-13-22-17-11-12-18(21(25)27-7-3)19(15-17)23(4)20(24)16-26-14-6-2/h6,11-12,15,22H,2,5,7-10,13-14,16H2,1,3-4H3