2-[[1-[(2S)-2-(2-azanylethanoylamino)-3-cyclohexyl-propanoyl]piperidin-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-[(2S)-2-(2-azanylethanoylamino)-3-cyclohexyl-propanoyl]piperidin-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-[(2S)-2-[(2-aminoacetyl)amino]-3-cyclohexyl-propanoyl]piperidine-2-carbonyl]amino]acetic acid CAS Name: 2-[[[1-[(2S)-2-[(2-amino-1-oxoethyl)amino]-3-cyclohexyl-1-oxopropyl]-2-piperidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-[(2S)-2-[(2-aminoacetyl)amino]-3-cyclohexylpropanoyl]piperidine-2-carbonyl]amino]acetic acid Traditional Name: 2-[[1-[(2S)-3-cyclohexyl-2-(glycylamino)propanoyl]pipecoloyl]amino]acetic acid Formula: C19H32N4O5 MolecularWeight: 396.48118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N2CCCCC2C(=O)NCC(=O)O)NC(=O)CN

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)N2CCCCC2C(=O)NCC(=O)O)NC(=O)CN

InChI

InChI=1S/C19H32N4O5/c20-11-16(24)22-14(10-13-6-2-1-3-7-13)19(28)23-9-5-4-8-15(23)18(27)21-12-17(25)26/h13-15H,1-12,20H2,(H,21,27)(H,22,24)(H,25,26)/t14-,15?/m0/s1