2-(8,9,10,11-tetrahydrobenzo[a]anthracen-8-yl)propanedioic acid

Systemtic Name: 2-(8,9,10,11-tetrahydrobenzo[a]anthracen-8-yl)propanedioic acid Openeye Name: 2-(8,9,10,11-tetrahydrobenzo[a]anthracen-8-yl)propanedioic acid CAS Name: 2-(8,9,10,11-tetrahydrobenzo[a]anthracen-8-yl)propanedioic acid IUPAC Name: 2-(8,9,10,11-tetrahydrobenzo[a]anthracen-8-yl)propanedioic acid Traditional Name: 2-(8,9,10,11-tetrahydrobenz[a]anthracen-8-yl)malonic acid Formula: C21H18O4 MolecularWeight: 334.36522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C=C3C(=C2)C=CC4=CC=CC=C43)C(C(=O)O)C(=O)O

Isomeric SMILES

C1CC(C2=C(C1)C=C3C(=C2)C=CC4=CC=CC=C43)C(C(=O)O)C(=O)O

InChI

InChI=1S/C21H18O4/c22-20(23)19(21(24)25)16-7-3-5-13-10-17-14(11-18(13)16)9-8-12-4-1-2-6-15(12)17/h1-2,4,6,8-11,16,19H,3,5,7H2,(H,22,23)(H,24,25)