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1-[1-[2-[2-(phenylmethyl)-2-adamantyl]ethanoyl]azetidin-3-yl]carbonylazetidine-3-carboxylic acid

1-[1-[2-[2-(phenylmethyl)-2-adamantyl]ethanoyl]azetidin-3-yl]carbonylazetidine-3-carboxylic acid

Systemtic Name:1-[1-[2-[2-(phenylmethyl)-2-adamantyl]ethanoyl]azetidin-3-yl]carbonylazetidine-3-carboxylic acid
Openeye Name:1-[1-[2-(2-benzyl-2-adamantyl)acetyl]azetidine-3-carbonyl]azetidine-3-carboxylic acid
CAS Name:1-[oxo-[1-[1-oxo-2-[2-(phenylmethyl)-2-adamantyl]ethyl]-3-azetidinyl]methyl]-3-azetidinecarboxylic acid
IUPAC Name:1-[1-[2-(2-benzyl-2-adamantyl)acetyl]azetidine-3-carbonyl]azetidine-3-carboxylic acid
Traditional Name:1-[1-[2-(2-benzyl-2-adamantyl)acetyl]azetidine-3-carbonyl]azetidine-3-carboxylic acid
Formula: C27H34N2O4
MolecularWeight: 450.56986
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(CC4=CC=CC=C4)CC(=O)N5CC(C5)C(=O)N6CC(C6)C(=O)O


Isomeric SMILES

C1C2CC3CC1CC(C2)C3(CC4=CC=CC=C4)CC(=O)N5CC(C5)C(=O)N6CC(C6)C(=O)O


InChI

InChI=1S/C27H34N2O4/c30-24(28-13-20(14-28)25(31)29-15-21(16-29)26(32)33)12-27(11-17-4-2-1-3-5-17)22-7-18-6-19(9-22)10-23(27)8-18/h1-5,18-23H,6-16H2,(H,32,33)


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