(2S,3R,6S)-10-ethanoyl-N6,12-dimethyl-N2-oxidanyl-4-oxidanylidene-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-2,6-dicarboxamide

Systemtic Name: (2S,3R,6S)-10-ethanoyl-N6,12-dimethyl-N2-oxidanyl-4-oxidanylidene-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-2,6-dicarboxamide Openeye Name: (2S,3R,6S)-10-acetyl-2-(hydroxycarbamoyl)-N,12-dimethyl-4-oxo-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-6-carboxamide CAS Name: (2S,3R,6S)-10-acetyl-N2-hydroxy-N6,12-dimethyl-4-oxo-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-2,6-dicarboxamide IUPAC Name: (2S,3R,6S)-10-acetyl-2-N-hydroxy-6-N,12-dimethyl-4-oxo-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-2,6-dicarboxamide Traditional Name: (2S,3R,6S)-10-acetyl-2-(hydroxycarbamoyl)-4-keto-N,12-dimethyl-3-(3-phenylpropyl)-1-oxa-5,10-diazacyclotetradecane-6-carboxamide Formula: C26H40N4O6 MolecularWeight: 504.619

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCOC(C(C(=O)NC(CCCN(C1)C(=O)C)C(=O)NC)CCCC2=CC=CC=C2)C(=O)NO

Isomeric SMILES

CC1CCO[C@@H]([C@H](C(=O)N[C@@H](CCCN(C1)C(=O)C)C(=O)NC)CCCC2=CC=CC=C2)C(=O)NO

InChI

InChI=1S/C26H40N4O6/c1-18-14-16-36-23(26(34)29-35)21(12-7-11-20-9-5-4-6-10-20)24(32)28-22(25(33)27-3)13-8-15-30(17-18)19(2)31/h4-6,9-10,18,21-23,35H,7-8,11-17H2,1-3H3,(H,27,33)(H,28,32)(H,29,34)/t18?,21-,22+,23+/m1/s1