N-(1-adamantylmethyl)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(1-adamantylmethyl)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(1-adamantylmethyl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(1-adamantylmethyl)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(1-adamantylmethyl)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(1-adamantylmethyl)-3-tosyl-propionamide Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29NO3S/c1-15-2-4-19(5-3-15)26(24,25)7-6-20(23)22-14-21-11-16-8-17(12-21)10-18(9-16)13-21/h2-5,16-18H,6-14H2,1H3,(H,22,23)