(9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-dione

Systemtic Name: (9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-dione Openeye Name: (9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-dione CAS Name: (9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-dione IUPAC Name: (9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-dione Traditional Name: (9R,10S)-9,10-diphenyl-1,4,8,11-tetrazacyclotetradecane-5,14-quinone Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C(NCCC(=O)NCCNC1=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN[C@H]([C@H](NCCC(=O)NCCNC1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2/c27-19-11-13-25-21(17-7-3-1-4-8-17)22(18-9-5-2-6-10-18)26-14-12-20(28)24-16-15-23-19/h1-10,21-22,25-26H,11-16H2,(H,23,27)(H,24,28)/t21-,22+