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4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid

4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid

Systemtic Name:4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid
Openeye Name:4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid
CAS Name:4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid
IUPAC Name:4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid
Traditional Name:4-[2-(9-acetamido-9,10-dihydroanthracen-1-yl)ethyl]benzoic acid
Formula: C25H23NO3
MolecularWeight: 385.45502
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2=CC=CC=C2CC3=C1C(=CC=C3)CCC4=CC=C(C=C4)C(=O)O


Isomeric SMILES

CC(=O)NC1C2=CC=CC=C2CC3=C1C(=CC=C3)CCC4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C25H23NO3/c1-16(27)26-24-22-8-3-2-5-20(22)15-21-7-4-6-18(23(21)24)12-9-17-10-13-19(14-11-17)25(28)29/h2-8,10-11,13-14,24H,9,12,15H2,1H3,(H,26,27)(H,28,29)


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