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2-[naphthalen-1-yl(phenanthren-4-yl)methyl]butanedioic acid

2-[naphthalen-1-yl(phenanthren-4-yl)methyl]butanedioic acid

Systemtic Name:2-[naphthalen-1-yl(phenanthren-4-yl)methyl]butanedioic acid
Openeye Name:2-[1-naphthyl(4-phenanthryl)methyl]butanedioic acid
CAS Name:2-[1-naphthalenyl(4-phenanthrenyl)methyl]butanedioic acid
IUPAC Name:2-[naphthalen-1-yl(phenanthren-4-yl)methyl]butanedioic acid
Traditional Name:2-[1-naphthyl(4-phenanthryl)methyl]succinic acid
Formula: C29H22O4
MolecularWeight: 434.48258
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(C3=CC=CC4=C3C5=CC=CC=C5C=C4)C(CC(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(C3=CC=CC4=C3C5=CC=CC=C5C=C4)C(CC(=O)O)C(=O)O


InChI

InChI=1S/C29H22O4/c30-26(31)17-25(29(32)33)28(23-13-5-9-18-7-1-3-11-21(18)23)24-14-6-10-20-16-15-19-8-2-4-12-22(19)27(20)24/h1-16,25,28H,17H2,(H,30,31)(H,32,33)


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