diethyl 2-[ethanoyl-[[4-(pentan-3-ylamino)phenyl]methyl]amino]propanedioate

Systemtic Name: diethyl 2-[ethanoyl-[[4-(pentan-3-ylamino)phenyl]methyl]amino]propanedioate Openeye Name: diethyl 2-[acetyl-[[4-(1-ethylpropylamino)phenyl]methyl]amino]propanedioate CAS Name: 2-[acetyl-[[4-(pentan-3-ylamino)phenyl]methyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[acetyl-[[4-(pentan-3-ylamino)phenyl]methyl]amino]propanedioate Traditional Name: 2-[acetyl-[4-(1-ethylpropylamino)benzyl]amino]malonic acid diethyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=CC=C(C=C1)CN(C(C(=O)OCC)C(=O)OCC)C(=O)C

Isomeric SMILES

CCC(CC)NC1=CC=C(C=C1)CN(C(C(=O)OCC)C(=O)OCC)C(=O)C

InChI

InChI=1S/C21H32N2O5/c1-6-17(7-2)22-18-12-10-16(11-13-18)14-23(15(5)24)19(20(25)27-8-3)21(26)28-9-4/h10-13,17,19,22H,6-9,14H2,1-5H3