methyl 2-[3-(dibutylamino)propylcarbamoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[3-(dibutylamino)propylcarbamoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[3-(dibutylamino)propylcarbamoylamino]-3-phenyl-propanoate CAS Name: 2-[[[3-(dibutylamino)propylamino]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[3-(dibutylamino)propylcarbamoylamino]-3-phenylpropanoate Traditional Name: 2-[3-(dibutylamino)propylcarbamoylamino]-3-phenyl-propionic acid methyl ester Formula: C22H37N3O3 MolecularWeight: 391.54748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCNC(=O)NC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCN(CCCC)CCCNC(=O)NC(CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C22H37N3O3/c1-4-6-15-25(16-7-5-2)17-11-14-23-22(27)24-20(21(26)28-3)18-19-12-9-8-10-13-19/h8-10,12-13,20H,4-7,11,14-18H2,1-3H3,(H2,23,24,27)