N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-4-phenyl-benzamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-4-phenyl-benzamide Openeye Name: N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-oxo-ethyl]-4-phenyl-benzamide CAS Name: N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-oxoethyl]-4-phenylbenzamide IUPAC Name: N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-oxoethyl]-4-phenylbenzamide Traditional Name: N-[(1S)-1-(1-adamantyl)-2-(2-dimethylaminoethylamino)-2-keto-ethyl]-4-phenyl-benzamide Formula: C29H37N3O2 MolecularWeight: 459.62298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CN(C)CCNC(=O)[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H37N3O2/c1-32(2)13-12-30-28(34)26(29-17-20-14-21(18-29)16-22(15-20)19-29)31-27(33)25-10-8-24(9-11-25)23-6-4-3-5-7-23/h3-11,20-22,26H,12-19H2,1-2H3,(H,30,34)(H,31,33)/t20?,21?,22?,26-,29?/m1/s1