2-(7-pentan-3-yl-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene)propanedioic acid

Systemtic Name: 2-(7-pentan-3-yl-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene)propanedioic acid Openeye Name: 2-[7-(1-ethylpropyl)-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene]propanedioic acid CAS Name: 2-(7-pentan-3-yl-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene)propanedioic acid IUPAC Name: 2-(7-pentan-3-yl-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene)propanedioic acid Traditional Name: 2-[7-(1-ethylpropyl)-4,4a,5,6-tetrahydro-3H-naphthalen-2-ylidene]malonic acid Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC2=CC(=C(C(=O)O)C(=O)O)CCC2CC1

Isomeric SMILES

CCC(CC)C1=CC2=CC(=C(C(=O)O)C(=O)O)CCC2CC1

InChI

InChI=1S/C18H24O4/c1-3-11(4-2)13-7-5-12-6-8-14(10-15(12)9-13)16(17(19)20)18(21)22/h9-12H,3-8H2,1-2H3,(H,19,20)(H,21,22)