[2-morpholin-4-yl-3-oxidanylidene-3-(pentylamino)propyl] 4-methylbenzoate

Systemtic Name: [2-morpholin-4-yl-3-oxidanylidene-3-(pentylamino)propyl] 4-methylbenzoate Openeye Name: [2-morpholino-3-oxo-3-(pentylamino)propyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(4-morpholinyl)-3-oxo-3-(pentylamino)propyl] ester IUPAC Name: [2-morpholin-4-yl-3-oxo-3-(pentylamino)propyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-(amylamino)-3-keto-2-morpholino-propyl] ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(COC(=O)C1=CC=C(C=C1)C)N2CCOCC2

Isomeric SMILES

CCCCCNC(=O)C(COC(=O)C1=CC=C(C=C1)C)N2CCOCC2

InChI

InChI=1S/C20H30N2O4/c1-3-4-5-10-21-19(23)18(22-11-13-25-14-12-22)15-26-20(24)17-8-6-16(2)7-9-17/h6-9,18H,3-5,10-15H2,1-2H3,(H,21,23)