methyl 3-azanyl-4-(4-propanoylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-azanyl-4-(4-propanoylpiperazin-1-yl)benzoate Openeye Name: methyl 3-amino-4-(4-propanoylpiperazin-1-yl)benzoate CAS Name: 3-amino-4-[4-(1-oxopropyl)-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-(4-propanoylpiperazin-1-yl)benzoate Traditional Name: 3-amino-4-(4-propionylpiperazino)benzoic acid methyl ester Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)N

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)N

InChI

InChI=1S/C15H21N3O3/c1-3-14(19)18-8-6-17(7-9-18)13-5-4-11(10-12(13)16)15(20)21-2/h4-5,10H,3,6-9,16H2,1-2H3