2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-3-(1H-indol-2-yl)propanoic acid

Systemtic Name: 2-[[1-(2-azanylpropanoyl)piperidin-4-yl]carbonylamino]-3-(1H-indol-2-yl)propanoic acid Openeye Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-3-(1H-indol-2-yl)propanoic acid CAS Name: 2-[[[1-(2-amino-1-oxopropyl)-4-piperidinyl]-oxomethyl]amino]-3-(1H-indol-2-yl)propanoic acid IUPAC Name: 2-[[1-(2-aminopropanoyl)piperidine-4-carbonyl]amino]-3-(1H-indol-2-yl)propanoic acid Traditional Name: 2-[(1-alanylisonipecotoyl)amino]-3-(1H-indol-2-yl)propionic acid Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC3=CC=CC=C3N2)C(=O)O)N

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)NC(CC2=CC3=CC=CC=C3N2)C(=O)O)N

InChI

InChI=1S/C20H26N4O4/c1-12(21)19(26)24-8-6-13(7-9-24)18(25)23-17(20(27)28)11-15-10-14-4-2-3-5-16(14)22-15/h2-5,10,12-13,17,22H,6-9,11,21H2,1H3,(H,23,25)(H,27,28)