propyl 4-[2-(4-methyl-1,4-diazepan-1-yl)ethanoylamino]benzoate

Systemtic Name: propyl 4-[2-(4-methyl-1,4-diazepan-1-yl)ethanoylamino]benzoate Openeye Name: propyl 4-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methyl-1,4-diazepan-1-yl)-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-methyl-1,4-diazepan-1-yl)acetyl]amino]benzoic acid propyl ester Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCCN(CC2)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCCN(CC2)C

InChI

InChI=1S/C18H27N3O3/c1-3-13-24-18(23)15-5-7-16(8-6-15)19-17(22)14-21-10-4-9-20(2)11-12-21/h5-8H,3-4,9-14H2,1-2H3,(H,19,22)