4-[[(E)-6-methyl-9-phenyl-non-4-enyl]-propyl-carbamoyl]cyclobutane-1,2,3-tricarboxylic acid

Systemtic Name: 4-[[(E)-6-methyl-9-phenyl-non-4-enyl]-propyl-carbamoyl]cyclobutane-1,2,3-tricarboxylic acid Openeye Name: 4-[[(E)-6-methyl-9-phenyl-non-4-enyl]-propyl-carbamoyl]cyclobutane-1,2,3-tricarboxylic acid CAS Name: 4-[[[(E)-6-methyl-9-phenylnon-4-enyl]-propylamino]-oxomethyl]cyclobutane-1,2,3-tricarboxylic acid IUPAC Name: 4-[[(E)-6-methyl-9-phenylnon-4-enyl]-propylcarbamoyl]cyclobutane-1,2,3-tricarboxylic acid Traditional Name: 4-[[(E)-6-methyl-9-phenyl-non-4-enyl]-propyl-carbamoyl]cyclobutane-1,2,3-tricarboxylic acid Formula: C27H37NO7 MolecularWeight: 487.58518

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC=CC(C)CCCC1=CC=CC=C1)C(=O)C2C(C(C2C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCN(CCC/C=C/C(C)CCCC1=CC=CC=C1)C(=O)C2C(C(C2C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C27H37NO7/c1-3-16-28(24(29)20-21(25(30)31)23(27(34)35)22(20)26(32)33)17-9-5-6-11-18(2)12-10-15-19-13-7-4-8-14-19/h4,6-8,11,13-14,18,20-23H,3,5,9-10,12,15-17H2,1-2H3,(H,30,31)(H,32,33)(H,34,35)/b11-6+