(1S)-2-[(2R)-4-(1-adamantyl)-2-azanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]cyclopropane-1-carboxylic acid

Systemtic Name: (1S)-2-[(2R)-4-(1-adamantyl)-2-azanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]cyclopropane-1-carboxylic acid Openeye Name: (1S)-2-[(1R)-3-(1-adamantyl)-1-amino-1-carboxy-propyl]cyclopropanecarboxylic acid CAS Name: (1S)-2-[(2R)-4-(1-adamantyl)-2-amino-1-hydroxy-1-oxobutan-2-yl]-1-cyclopropanecarboxylic acid IUPAC Name: (1S)-2-[(2R)-4-(1-adamantyl)-2-amino-1-hydroxy-1-oxobutan-2-yl]cyclopropane-1-carboxylic acid Traditional Name: (1S)-2-[(1R)-3-(1-adamantyl)-1-amino-1-carboxy-propyl]cyclopropanecarboxylic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCC(C4CC4C(=O)O)(C(=O)O)N

Isomeric SMILES

C1[C@@H](C1[C@](CCC23CC4CC(C2)CC(C4)C3)(C(=O)O)N)C(=O)O

InChI

InChI=1S/C18H27NO4/c19-18(16(22)23,14-6-13(14)15(20)21)2-1-17-7-10-3-11(8-17)5-12(4-10)9-17/h10-14H,1-9,19H2,(H,20,21)(H,22,23)/t10?,11?,12?,13-,14?,17?,18+/m0/s1