N-[(E)-[4-(2-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-methyl-2-oxidanyl-benzamide

Systemtic Name: N-[(E)-[4-(2-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-methyl-2-oxidanyl-benzamide Openeye Name: N-[(E)-[3-(2-adamantylamino)-1-methyl-3-oxo-propylidene]amino]-2-hydroxy-3-methyl-benzamide CAS Name: N-[(E)-[4-(2-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-hydroxy-3-methylbenzamide IUPAC Name: N-[(E)-[4-(2-adamantylamino)-4-oxobutan-2-ylidene]amino]-2-hydroxy-3-methylbenzamide Traditional Name: N-[(E)-[3-(2-adamantylamino)-3-keto-1-methyl-propylidene]amino]-2-hydroxy-3-methyl-benzamide Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)NN=C(C)CC(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N/N=C(\C)/CC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C22H29N3O3/c1-12-4-3-5-18(21(12)27)22(28)25-24-13(2)6-19(26)23-20-16-8-14-7-15(10-16)11-17(20)9-14/h3-5,14-17,20,27H,6-11H2,1-2H3,(H,23,26)(H,25,28)/b24-13+