methyl 11-methyl-5,12-bis(oxidanylidene)-6-[[(1R)-2-oxidanyl-1-phenyl-ethyl]carbamoyl]-1-oxa-4-azacyclododec-8-ene-3-carboxylate

Systemtic Name: methyl 11-methyl-5,12-bis(oxidanylidene)-6-[[(1R)-2-oxidanyl-1-phenyl-ethyl]carbamoyl]-1-oxa-4-azacyclododec-8-ene-3-carboxylate Openeye Name: methyl 6-[[(1R)-2-hydroxy-1-phenyl-ethyl]carbamoyl]-11-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylate CAS Name: 6-[[[(1R)-2-hydroxy-1-phenylethyl]amino]-oxomethyl]-11-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[[(1R)-2-hydroxy-1-phenylethyl]carbamoyl]-11-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylate Traditional Name: 6-[[(1R)-2-hydroxy-1-phenyl-ethyl]carbamoyl]-5,12-diketo-11-methyl-1-oxa-4-azacyclododec-8-ene-3-carboxylic acid methyl ester Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=CCC(C(=O)NC(COC1=O)C(=O)OC)C(=O)NC(CO)C2=CC=CC=C2

Isomeric SMILES

CC1CC=CCC(C(=O)NC(COC1=O)C(=O)OC)C(=O)N[C@@H](CO)C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O7/c1-14-8-6-7-11-16(19(26)23-17(12-25)15-9-4-3-5-10-15)20(27)24-18(22(29)30-2)13-31-21(14)28/h3-7,9-10,14,16-18,25H,8,11-13H2,1-2H3,(H,23,26)(H,24,27)/t14?,16?,17-,18?/m0/s1