5-(1-adamantyl)-2-[(2-methylphenyl)carbonylamino]-3-oxidanylidene-pentanoic acid

Systemtic Name: 5-(1-adamantyl)-2-[(2-methylphenyl)carbonylamino]-3-oxidanylidene-pentanoic acid Openeye Name: 5-(1-adamantyl)-2-[(2-methylbenzoyl)amino]-3-oxo-pentanoic acid CAS Name: 5-(1-adamantyl)-2-[[(2-methylphenyl)-oxomethyl]amino]-3-oxopentanoic acid IUPAC Name: 5-(1-adamantyl)-2-[(2-methylbenzoyl)amino]-3-oxopentanoic acid Traditional Name: 5-(1-adamantyl)-3-keto-2-(o-toluoylamino)valeric acid Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(=O)CCC23CC4CC(C2)CC(C4)C3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(C(=O)CCC23CC4CC(C2)CC(C4)C3)C(=O)O

InChI

InChI=1S/C23H29NO4/c1-14-4-2-3-5-18(14)21(26)24-20(22(27)28)19(25)6-7-23-11-15-8-16(12-23)10-17(9-15)13-23/h2-5,15-17,20H,6-13H2,1H3,(H,24,26)(H,27,28)