2-[(E)-3-butoxy-1-[4-[(Z)-2-butoxycarbonyl-3-carboxy-hex-1-enyl]phenyl]-3-oxidanylidene-prop-1-en-2-yl]pentanoic acid

Systemtic Name: 2-[(E)-3-butoxy-1-[4-[(Z)-2-butoxycarbonyl-3-carboxy-hex-1-enyl]phenyl]-3-oxidanylidene-prop-1-en-2-yl]pentanoic acid Openeye Name: 2-[(E)-1-butoxycarbonyl-2-[4-[(Z)-2-butoxycarbonyl-3-carboxy-hex-1-enyl]phenyl]vinyl]pentanoic acid CAS Name: 2-[(E)-3-butoxy-1-[4-[(Z)-2-[butoxy(oxo)methyl]-3-carboxyhex-1-enyl]phenyl]-3-oxoprop-1-en-2-yl]pentanoic acid IUPAC Name: 2-[(E)-3-butoxy-1-[4-[(Z)-2-butoxycarbonyl-3-carboxyhex-1-enyl]phenyl]-3-oxoprop-1-en-2-yl]pentanoic acid Traditional Name: (E)-3-butoxycarbonyl-4-[4-[(Z)-2-butoxycarbonyl-3-carboxy-hex-1-enyl]phenyl]-2-propyl-but-3-enoic acid Formula: C30H42O8 MolecularWeight: 530.64968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC=C(C=C1)C=C(C(CCC)C(=O)O)C(=O)OCCCC)C(CCC)C(=O)O

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC=C(C=C1)/C=C(/C(CCC)C(=O)O)\C(=O)OCCCC)/C(CCC)C(=O)O

InChI

InChI=1S/C30H42O8/c1-5-9-17-37-29(35)25(23(11-7-3)27(31)32)19-21-13-15-22(16-14-21)20-26(24(12-8-4)28(33)34)30(36)38-18-10-6-2/h13-16,19-20,23-24H,5-12,17-18H2,1-4H3,(H,31,32)(H,33,34)/b25-19-,26-20+