2-[(4-cyclohexylpiperazin-1-yl)-ethanoyl-amino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(4-cyclohexylpiperazin-1-yl)-ethanoyl-amino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[acetyl-(4-cyclohexylpiperazin-1-yl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[acetyl-(4-cyclohexyl-1-piperazinyl)amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[acetyl-(4-cyclohexylpiperazin-1-yl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[acetyl-(4-cyclohexylpiperazino)amino]-3-(1H-indol-3-yl)propionic acid Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(CC1=CNC2=CC=CC=C21)C(=O)O)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC(=O)N(C(CC1=CNC2=CC=CC=C21)C(=O)O)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C23H32N4O3/c1-17(28)27(26-13-11-25(12-14-26)19-7-3-2-4-8-19)22(23(29)30)15-18-16-24-21-10-6-5-9-20(18)21/h5-6,9-10,16,19,22,24H,2-4,7-8,11-15H2,1H3,(H,29,30)