N-[(Z)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-phenyl-benzamide

Systemtic Name: N-[(Z)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-phenyl-benzamide Openeye Name: N-[(Z)-[3-(1-adamantylamino)-1-methyl-3-oxo-propylidene]amino]-4-phenyl-benzamide CAS Name: N-[(Z)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-4-phenylbenzamide IUPAC Name: N-[(Z)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-4-phenylbenzamide Traditional Name: N-[(Z)-[3-(1-adamantylamino)-3-keto-1-methyl-propylidene]amino]-4-phenyl-benzamide Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)/CC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H31N3O2/c1-18(11-25(31)28-27-15-19-12-20(16-27)14-21(13-19)17-27)29-30-26(32)24-9-7-23(8-10-24)22-5-3-2-4-6-22/h2-10,19-21H,11-17H2,1H3,(H,28,31)(H,30,32)/b29-18-